(1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine

C116H159N31O10 — CID 167671648

IUPAC(1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine
SMILESCCN(C)c1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.CCN(CC)c1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.Cc1ncc(Oc2cc(C(C)(C)C)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(C3CCCO3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(C3CCOC3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(N3CCCC3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc([C@@H](C)O)ncc2C(C)C)c(N)n1
InChIInChI=1S/C17H23N5O.C17H25N5O.2C17H22N4O2.C17H24N4O.C16H23N5O.C15H20N4O2/c1-11(2)13-9-20-16(22-6-4-5-7-22)8-14(13)23-15-10-19-12(3)21-17(15)18;1-6-22(7-2)16-8-14(13(9-20-16)11(3)4)23-15-10-19-12(5)21-17(15)18;1-10(2)13-7-20-14(12-4-5-22-9-12)6-15(13)23-16-8-19-11(3)21-17(16)18;1-10(2)12-8-20-13(14-5-4-6-22-14)7-15(12)23-16-9-19-11(3)21-17(16)18;1-10(2)12-8-20-15(17(4,5)6)7-13(12)22-14-9-19-11(3)21-16(14)18;1-6-21(5)15-7-13(12(8-19-15)10(2)3)22-14-9-18-11(4)20-16(14)17;1-8(2)11-6-18-12(9(3)20)5-13(11)21-14-7-17-10(4)19-15(14)16/h8-11H,4-7H2,1-3H3,(H2,18,19,21);8-11H,6-7H2,1-5H3,(H2,18,19,21);6-8,10,12H,4-5,9H2,1-3H3,(H2,18,19,21);7-10,14H,4-6H2,1-3H3,(H2,18,19,21);7-10H,1-6H3,(H2,18,19,21);7-10H,6H2,1-5H3,(H2,17,18,20);5-9,20H,1-4H3,(H2,16,17,19)/t;;;;;;9-/m......1/s1
InChIKeyUEZSGHQQEKTPSI-VZKOUNTFSA-N
MW2147.75 g/mol
LogP23.35
Rot. Bonds30

About (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine

(1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine (PubChem CID 167671648) has the molecular formula C116H159N31O10 and a molecular weight of 2147.75 g/mol. Its IUPAC name is (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine.

Molecular Properties

Compound Name(1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine
PubChem CID167671648
Molecular FormulaC116H159N31O10
Molecular Weight2147.75 g/mol
Exact Mass2146.29
IUPAC Name(1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine
SMILESCCN(C)c1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.CCN(CC)c1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.Cc1ncc(Oc2cc(C(C)(C)C)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(C3CCCO3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(C3CCOC3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(N3CCCC3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc([C@@H](C)O)ncc2C(C)C)c(N)n1
InChIInChI=1S/C17H23N5O.C17H25N5O.2C17H22N4O2.C17H24N4O.C16H23N5O.C15H20N4O2/c1-11(2)13-9-20-16(22-6-4-5-7-22)8-14(13)23-15-10-19-12(3)21-17(15)18;1-6-22(7-2)16-8-14(13(9-20-16)11(3)4)23-15-10-19-12(5)21-17(15)18;1-10(2)13-7-20-14(12-4-5-22-9-12)6-15(13)23-16-8-19-11(3)21-17(16)18;1-10(2)12-8-20-13(14-5-4-6-22-14)7-15(12)23-16-9-19-11(3)21-17(16)18;1-10(2)12-8-20-15(17(4,5)6)7-13(12)22-14-9-19-11(3)21-16(14)18;1-6-21(5)15-7-13(12(8-19-15)10(2)3)22-14-9-18-11(4)20-16(14)17;1-8(2)11-6-18-12(9(3)20)5-13(11)21-14-7-17-10(4)19-15(14)16/h8-11H,4-7H2,1-3H3,(H2,18,19,21);8-11H,6-7H2,1-5H3,(H2,18,19,21);6-8,10,12H,4-5,9H2,1-3H3,(H2,18,19,21);7-10,14H,4-6H2,1-3H3,(H2,18,19,21);7-10H,1-6H3,(H2,18,19,21);7-10H,6H2,1-5H3,(H2,17,18,20);5-9,20H,1-4H3,(H2,16,17,19)/t;;;;;;9-/m......1/s1
InChIKeyUEZSGHQQEKTPSI-VZKOUNTFSA-N
XLogP23.35
TPSA565.85 Ų
H-Bond Donors8
H-Bond Acceptors41
Rotatable Bonds30
Heavy Atoms157
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002147.75
LogP ≤ 523.35
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1041

Analyze (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

5-[2-cyclopropyl-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]-3-(1-pyridin-2-ylethoxy)pyridin-2-amine
CID 117688692
4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(2-cyclopropylethyl)pyridine;4-tert-butyl-6-[(1-methylpyrrolidin-3-yl)methyl]pyrimidine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;3-tert-butyl-5-(oxan-4-yloxy)pyridine;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine;N'-(4-tert-butyl-2-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine;4-tert-butyl-6-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyrimidine
CID 158510586
4-tert-butyl-2-(cyclobutylmethyl)pyridine;4-tert-butyl-2-(2-cyclopropylethyl)pyridine;4-tert-butyl-2-(oxan-4-ylmethyl)pyridine;3-tert-butyl-5-(oxan-4-yloxy)pyridine;4-tert-butyl-2-(2-pyridin-2-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-3-ylethyl)pyridine;4-tert-butyl-2-(2-pyridin-4-ylethyl)pyridine;N'-(4-tert-butyl-2-pyridinyl)-N,N,N'-trimethylethane-1,2-diamine;4-tert-butyl-6-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyrimidine
CID 158620051
2-[4-[[4-[[6-Cyclopropyl-2-(oxan-4-yl)-3-pyridinyl]oxy]-2-pyridinyl]amino]-2-pyridinyl]propan-2-ol;2-[4-[[4-[(2,6-dimethyl-3-pyridinyl)oxy]-2-pyridinyl]amino]-2-pyridinyl]propan-2-ol;2-[5-[[4-[(2,6-dimethyl-3-pyridinyl)oxy]-2-pyridinyl]amino]-2-pyridinyl]propan-2-ol;2-[4-[[4-[(6-methoxy-2-methyl-3-pyridinyl)oxy]-2-pyridinyl]amino]-2-pyridinyl]propan-2-ol;2-[4-[[4-[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]oxy]-2-pyridinyl]amino]-2-pyridinyl]propan-2-ol
CID 159465056
bis(2-[1-[6-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-2-[3-fluoro-3-(methoxymethyl)pyrrolidin-1-yl]pyrimidin-4-yl]-3-fluoropyrrolidin-3-yl]ethanol);3-(difluoromethoxy)-5-[2-(4,4-difluoropiperidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine;3-(difluoromethoxy)-5-[2-(3-fluoropiperidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine;3-fluoro-5-[2-(3-fluoro-3-methylpyrrolidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine
CID 159706090
2-[1-[6-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-2-[3-fluoro-3-(methoxymethyl)pyrrolidin-1-yl]pyrimidin-4-yl]-3-fluoropyrrolidin-3-yl]ethanol;3-(difluoromethoxy)-5-[2-(4,4-difluoropiperidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine;3-(difluoromethoxy)-5-[2-(3-fluoropiperidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine
CID 160533215
bis(2-[1-[6-[6-amino-5-(difluoromethoxy)-3-pyridinyl]-2-[3-fluoro-3-(methoxymethyl)pyrrolidin-1-yl]pyrimidin-4-yl]-3-fluoropyrrolidin-3-yl]ethanol);5-[2-(2-azabicyclo[2.1.1]hexan-2-yl)-6-(7-fluoro-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)pyrimidin-4-yl]-3-(difluoromethoxy)pyridin-2-amine;3-(difluoromethoxy)-5-[2-(3,3-difluoropyrrolidin-1-yl)-6-(7-fluoro-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)pyrimidin-4-yl]pyridin-2-amine;3-(difluoromethoxy)-5-[2-[(3S)-3-fluoro-3-methylpyrrolidin-1-yl]-6-(7-fluoro-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)pyrimidin-4-yl]pyridin-2-amine
CID 161193599
(3S)-1-[2-[[2-(2-fluoro-6-methoxyphenyl)pyrimidin-4-yl]amino]-5-[5-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]-4-pyridinyl]piperidin-3-ol
CID 172626282
5-[2-Cyclopropyl-6-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)pyrimidin-4-yl]-3-(1-pyridin-2-ylethoxy)pyridin-2-amine
CID 123662744
3-[(1R,5S)-6-[6-(6-amino-5-pyridin-2-yloxy-3-pyridinyl)-2-cyclopropylpyrimidin-4-yl]-3-azabicyclo[3.1.0]hexan-3-yl]propan-1-ol
CID 134505337
[5-[2-[2-[[5-[2-[2-Methoxy-4-(1-methylpyrrolidin-3-yl)oxyanilino]pyrimidin-4-yl]-3-methyl-1,2-dihydropyrrolo[2,3-b]pyridin-3-yl]methoxymethoxy]-4-(1-methylpiperidin-4-yl)oxyanilino]pyrimidin-4-yl]-3-methyl-1,2-dihydropyrrolo[2,3-b]pyridin-3-yl]methanol
CID 137400195
1-[6-[(5-Methoxy-3-pyridinyl)amino]-5-[2-methyl-9-(oxan-2-yl)purin-6-yl]-3-pyridinyl]-2,2-dimethylpropan-1-ol
CID 142788983

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine?
The IUPAC name of (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine (CID 167671648) is (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine.
What is the SMILES notation for (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine?
The canonical SMILES for (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine is CCN(C)c1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.CCN(CC)c1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.Cc1ncc(Oc2cc(C(C)(C)C)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(C3CCCO3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(C3CCOC3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc(N3CCCC3)ncc2C(C)C)c(N)n1.Cc1ncc(Oc2cc([C@@H](C)O)ncc2C(C)C)c(N)n1.
What is the InChIKey of (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine?
The InChIKey is UEZSGHQQEKTPSI-VZKOUNTFSA-N. The full InChI is InChI=1S/C17H23N5O.C17H25N5O.2C17H22N4O2.C17H24N4O.C16H23N5O.C15H20N4O2/c1-11(2)13-9-20-16(22-6-4-5-7-22)8-14(13)23-15-10-19-12(3)21-17(15)18;1-6-22(7-2)16-8-14(13(9-20-16)11(3)4)23-15-10-19-12(5)21-17(15)18;1-10(2)13-7-20-14(12-4-5-22-9-12)6-15(13)23-16-8-19-11(3)21-17(16)18;1-10(2)12-8-20-13(14-5-4-6-22-14)7-15(12)23-16-9-19-11(3)21-17(16)18;1-10(2)12-8-20-15(17(4,5)6)7-13(12)22-14-9-19-11(3)21-16(14)18;1-6-21(5)15-7-13(12(8-19-15)10(2)3)22-14-9-18-11(4)20-16(14)17;1-8(2)11-6-18-12(9(3)20)5-13(11)21-14-7-17-10(4)19-15(14)16/h8-11H,4-7H2,1-3H3,(H2,18,19,21);8-11H,6-7H2,1-5H3,(H2,18,19,21);6-8,10,12H,4-5,9H2,1-3H3,(H2,18,19,21);7-10,14H,4-6H2,1-3H3,(H2,18,19,21);7-10H,1-6H3,(H2,18,19,21);7-10H,6H2,1-5H3,(H2,17,18,20);5-9,20H,1-4H3,(H2,16,17,19)/t;;;;;;9-/m......1/s1.
What are the key properties of (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine?
(1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine has a molecular weight of 2147.75 g/mol, XLogP of 23.35, 30 rotatable bonds, 8 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]ethanol;5-[(2-tert-butyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[2-(diethylamino)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;5-[[2-[ethyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;2-methyl-5-[[2-(oxolan-2-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[[2-(oxolan-3-yl)-5-propan-2-yl-4-pyridinyl]oxy]pyrimidin-4-amine;2-methyl-5-[(5-propan-2-yl-2-pyrrolidin-1-yl-4-pyridinyl)oxy]pyrimidin-4-amine is sourced from PubChem (CID 167671648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).