4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine

C109H120N38O3 — CID 158815402

IUPAC4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
SMILESCOCCn1ccc2nc(N)nc(NC(C)c3cccnc3)c21.COCCn1ccc2nc(N)nc(NCc3cc(C4CC4)on3)c21.Cc1nc(NCc2cc(C)n(C)n2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(NCc2cn(C)cn2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(N[C@@H](C)c2ccccn2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(N[C@H](C)c2ccccn2)c2c(ccn2Cc2ccccn2)n1
InChIInChI=1S/2C20H20N6.C19H21N7.C18H19N7.C16H20N6O2.C16H20N6O/c2*1-14(17-8-4-6-11-22-17)23-20-19-18(24-15(2)25-20)9-12-26(19)13-16-7-3-5-10-21-16;1-13-10-16(24-25(13)3)11-21-19-18-17(22-14(2)23-19)7-9-26(18)12-15-6-4-5-8-20-15;1-13-22-16-6-8-25(11-14-5-3-4-7-19-14)17(16)18(23-13)20-9-15-10-24(2)12-21-15;1-23-7-6-22-5-4-12-14(22)15(20-16(17)19-12)18-9-11-8-13(24-21-11)10-2-3-10;1-11(12-4-3-6-18-10-12)19-15-14-13(20-16(17)21-15)5-7-22(14)8-9-23-2/h2*3-12,14H,13H2,1-2H3,(H,23,24,25);4-10H,11-12H2,1-3H3,(H,21,22,23);3-8,10,12H,9,11H2,1-2H3,(H,20,22,23);4-5,8,10H,2-3,6-7,9H2,1H3,(H3,17,18,19,20);3-7,10-11H,8-9H2,1-2H3,(H3,17,19,20,21)/t2*14-;;;;/m10..../s1
InChIKeyIVEYXSQTRIHJRC-IKBGVWIDSA-N
MW2010.42 g/mol
LogP17.23
Rot. Bonds33

About 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine

4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine (PubChem CID 158815402) has the molecular formula C109H120N38O3 and a molecular weight of 2010.42 g/mol. Its IUPAC name is 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
PubChem CID158815402
Molecular FormulaC109H120N38O3
Molecular Weight2010.42 g/mol
Exact Mass2009.04
IUPAC Name4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
SMILESCOCCn1ccc2nc(N)nc(NC(C)c3cccnc3)c21.COCCn1ccc2nc(N)nc(NCc3cc(C4CC4)on3)c21.Cc1nc(NCc2cc(C)n(C)n2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(NCc2cn(C)cn2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(N[C@@H](C)c2ccccn2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(N[C@H](C)c2ccccn2)c2c(ccn2Cc2ccccn2)n1
InChIInChI=1S/2C20H20N6.C19H21N7.C18H19N7.C16H20N6O2.C16H20N6O/c2*1-14(17-8-4-6-11-22-17)23-20-19-18(24-15(2)25-20)9-12-26(19)13-16-7-3-5-10-21-16;1-13-10-16(24-25(13)3)11-21-19-18-17(22-14(2)23-19)7-9-26(18)12-15-6-4-5-8-20-15;1-13-22-16-6-8-25(11-14-5-3-4-7-19-14)17(16)18(23-13)20-9-15-10-24(2)12-21-15;1-23-7-6-22-5-4-12-14(22)15(20-16(17)19-12)18-9-11-8-13(24-21-11)10-2-3-10;1-11(12-4-3-6-18-10-12)19-15-14-13(20-16(17)21-15)5-7-22(14)8-9-23-2/h2*3-12,14H,13H2,1-2H3,(H,23,24,25);4-10H,11-12H2,1-3H3,(H,21,22,23);3-8,10,12H,9,11H2,1-2H3,(H,20,22,23);4-5,8,10H,2-3,6-7,9H2,1H3,(H3,17,18,19,20);3-7,10-11H,8-9H2,1-2H3,(H3,17,19,20,21)/t2*14-;;;;/m10..../s1
InChIKeyIVEYXSQTRIHJRC-IKBGVWIDSA-N
XLogP17.23
TPSA478.84 Ų
H-Bond Donors8
H-Bond Acceptors41
Rotatable Bonds33
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002010.42
LogP ≤ 517.23
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1041

Analyze 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

2-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
CID 126585795
4-N-[2-[2-[[2-[[2-amino-4-[2-[[2-[[2-amino-4-[(5-cyclopropyl-1,2-oxazol-3-yl)methylamino]pyrrolo[3,2-d]pyrimidin-5-yl]methyl]-4-pyridinyl]methoxy]ethylamino]pyrrolo[3,2-d]pyrimidin-5-yl]methyl]-4-pyridinyl]oxy]ethoxy]ethyl]-5-[(6-methyl-2-pyridinyl)methyl]pyrrolo[3,2-d]pyrimidine-2,4-diamine
CID 126596167
4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-(pyrazin-2-ylmethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine
CID 118335026
3-[[2-amino-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-yl]amino]heptan-1-ol
CID 123857210
6-[[2-methyl-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]pyrrolo[3,2-d]pyrimidin-5-yl]methyl]pyridine-2-carboxamide
CID 126585792
2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrrolo[3,2-d]pyrimidin-4-amine
CID 126585667
1-(3-methoxypropyl)-N-(1-pyridin-3-ylethyl)imidazol-2-amine
CID 106561963
7-[2-[2-[[2-amino-5-[[4-[4-[[2-amino-5-[[(2R)-oxolan-2-yl]methyl]pyrrolo[3,2-d]pyrimidin-4-yl]amino]butyl]-2-pyridinyl]methyl]pyrrolo[3,2-d]pyrimidin-4-yl]amino]ethoxy]propyl]-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-[[6-(trifluoromethyl)-2-pyridinyl]methyl]pyrrolo[3,2-d]pyrimidine-2,4-diamine
CID 126596028
5-benzyl-N-(2-methoxyethyl)-2-methylpyrrolo[3,2-d]pyrimidin-4-amine
CID 126585687
5-[(3-chloro-2-pyridinyl)methyl]-2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrrolo[3,2-d]pyrimidin-4-amine;5-[(4,6-dimethoxypyrimidin-2-yl)methyl]-4-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-[(2-methoxyphenyl)methyl]-4-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrrolo[3,2-d]pyrimidine-2,4-diamine;5-[(3-methoxy-2-pyridinyl)methyl]-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-(1,3-thiazol-4-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
CID 161103375
[2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine
CID 160958015
5-fluoro-4-N-(1-pyridin-3-ylethyl)pyrimidine-2,4-diamine
CID 80778949

Frequently Asked Questions

What is the IUPAC name of 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine?
The IUPAC name of 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine (CID 158815402) is 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine is COCCn1ccc2nc(N)nc(NC(C)c3cccnc3)c21.COCCn1ccc2nc(N)nc(NCc3cc(C4CC4)on3)c21.Cc1nc(NCc2cc(C)n(C)n2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(NCc2cn(C)cn2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(N[C@@H](C)c2ccccn2)c2c(ccn2Cc2ccccn2)n1.Cc1nc(N[C@H](C)c2ccccn2)c2c(ccn2Cc2ccccn2)n1.
What is the InChIKey of 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine?
The InChIKey is IVEYXSQTRIHJRC-IKBGVWIDSA-N. The full InChI is InChI=1S/2C20H20N6.C19H21N7.C18H19N7.C16H20N6O2.C16H20N6O/c2*1-14(17-8-4-6-11-22-17)23-20-19-18(24-15(2)25-20)9-12-26(19)13-16-7-3-5-10-21-16;1-13-10-16(24-25(13)3)11-21-19-18-17(22-14(2)23-19)7-9-26(18)12-15-6-4-5-8-20-15;1-13-22-16-6-8-25(11-14-5-3-4-7-19-14)17(16)18(23-13)20-9-15-10-24(2)12-21-15;1-23-7-6-22-5-4-12-14(22)15(20-16(17)19-12)18-9-11-8-13(24-21-11)10-2-3-10;1-11(12-4-3-6-18-10-12)19-15-14-13(20-16(17)21-15)5-7-22(14)8-9-23-2/h2*3-12,14H,13H2,1-2H3,(H,23,24,25);4-10H,11-12H2,1-3H3,(H,21,22,23);3-8,10,12H,9,11H2,1-2H3,(H,20,22,23);4-5,8,10H,2-3,6-7,9H2,1H3,(H3,17,18,19,20);3-7,10-11H,8-9H2,1-2H3,(H3,17,19,20,21)/t2*14-;;;;/m10..../s1.
What are the key properties of 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine?
4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine has a molecular weight of 2010.42 g/mol, XLogP of 17.23, 33 rotatable bonds, 8 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]-5-(2-methoxyethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-methyl-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-(2-methoxyethyl)-4-N-(1-pyridin-3-ylethyl)pyrrolo[3,2-d]pyrimidine-2,4-diamine;2-methyl-N-[(1-methylimidazol-4-yl)methyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1R)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-methyl-N-[(1S)-1-pyridin-2-ylethyl]-5-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 158815402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).