3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine

C63H82ClN23O2Sn — CID 158527246

IUPAC3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine
SMILESCC(C)Nc1nccc2c1C(c1cc(N3CCOCC3)ncn1)=NC2.CC(C)Nc1nccc2c1c(-c1cc(Cl)ncn1)nn2C.CC(C)Nc1nccc2c1c(-c1cc(N3CCOCC3)ncn1)nn2C.CC(C)Nc1nccc2c1c([Sn](C)(C)C)nn2C
InChIInChI=1S/C18H23N7O.C18H22N6O.C14H15ClN6.C10H13N4.3CH3.Sn/c1-12(2)22-18-16-14(4-5-19-18)24(3)23-17(16)13-10-15(21-11-20-13)25-6-8-26-9-7-25;1-12(2)23-18-16-13(3-4-19-18)10-20-17(16)14-9-15(22-11-21-14)24-5-7-25-8-6-24;1-8(2)19-14-12-10(4-5-16-14)21(3)20-13(12)9-6-11(15)18-7-17-9;1-7(2)13-10-8-6-12-14(3)9(8)4-5-11-10;;;;/h4-5,10-12H,6-9H2,1-3H3,(H,19,22);3-4,9,11-12H,5-8,10H2,1-2H3,(H,19,23);4-8H,1-3H3,(H,16,19);4-5,7H,1-3H3,(H,11,13);3*1H3;
InChIKeyHMXXBEXNCBWIJM-UHFFFAOYSA-N
MW1347.67 g/mol
LogP9.19
Rot. Bonds14

About 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine

3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine (PubChem CID 158527246) has the molecular formula C63H82ClN23O2Sn and a molecular weight of 1347.67 g/mol. Its IUPAC name is 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine.

Molecular Properties

Compound Name3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine
PubChem CID158527246
Molecular FormulaC63H82ClN23O2Sn
Molecular Weight1347.67 g/mol
Exact Mass1347.57
IUPAC Name3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine
SMILESCC(C)Nc1nccc2c1C(c1cc(N3CCOCC3)ncn1)=NC2.CC(C)Nc1nccc2c1c(-c1cc(Cl)ncn1)nn2C.CC(C)Nc1nccc2c1c(-c1cc(N3CCOCC3)ncn1)nn2C.CC(C)Nc1nccc2c1c([Sn](C)(C)C)nn2C
InChIInChI=1S/C18H23N7O.C18H22N6O.C14H15ClN6.C10H13N4.3CH3.Sn/c1-12(2)22-18-16-14(4-5-19-18)24(3)23-17(16)13-10-15(21-11-20-13)25-6-8-26-9-7-25;1-12(2)23-18-16-13(3-4-19-18)10-20-17(16)14-9-15(22-11-21-14)24-5-7-25-8-6-24;1-8(2)19-14-12-10(4-5-16-14)21(3)20-13(12)9-6-11(15)18-7-17-9;1-7(2)13-10-8-6-12-14(3)9(8)4-5-11-10;;;;/h4-5,10-12H,6-9H2,1-3H3,(H,19,22);3-4,9,11-12H,5-8,10H2,1-2H3,(H,19,23);4-8H,1-3H3,(H,16,19);4-5,7H,1-3H3,(H,11,13);3*1H3;
InChIKeyHMXXBEXNCBWIJM-UHFFFAOYSA-N
XLogP9.19
TPSA267.78 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds14
Heavy Atoms90
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001347.67
LogP ≤ 59.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Analyze 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine with MolForge

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Related Compounds

4-[5-chloro-2-(4-fluorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyridin-3-yl]-N-cyclopentylpyrimidin-2-amine
CID 10141356
4-[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-c]pyrimidin-3-yl]-N-cyclopentylpyrimidin-2-amine
CID 45484944
1-[4-[4-[(5-Chloro-4-pyrazolo[1,5-a]pyridin-3-ylpyrimidin-2-yl)amino]-3,5-dimethylpyrazol-1-yl]piperidin-1-yl]-2-methoxyethanone
CID 127049475
2-[4-[4-[(5-Chloro-4-pyrazolo[1,5-a]pyridin-3-ylpyrimidin-2-yl)amino]-3,5-dimethylpyrazol-1-yl]piperidin-1-yl]ethanol
CID 127050856
4-N-(2-chlorophenyl)-4-N-(2-methoxyethyl)-6-[5-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidine-2,4-diamine
CID 57335845
7-[2-[5-[4-amino-5-(1-methylpyrazol-3-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-3-pyridinyl]ethyl]-2-ethyl-N-(2-methoxyethyl)-1,5-naphthyridin-4-amine
CID 156304030
(2S)-2-[[4-[4-[4-(5-benzylpyrimidin-2-yl)piperazin-1-yl]pyrrolo[2,1-f][1,2,4]triazin-6-yl]pyrazol-1-yl]methyl]morpholine
CID 118032959
US10023570, Example 645
CID 124199941
US10023570, Example 338
CID 124200013
US10023570, Example 741
CID 124200196
US10023570, Example 326
CID 124200467
US10023570, Example 335
CID 124200483

Frequently Asked Questions

What is the IUPAC name of 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
The IUPAC name of 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine (CID 158527246) is 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine.
What is the SMILES notation for 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
The canonical SMILES for 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine is CC(C)Nc1nccc2c1C(c1cc(N3CCOCC3)ncn1)=NC2.CC(C)Nc1nccc2c1c(-c1cc(Cl)ncn1)nn2C.CC(C)Nc1nccc2c1c(-c1cc(N3CCOCC3)ncn1)nn2C.CC(C)Nc1nccc2c1c([Sn](C)(C)C)nn2C.
What is the InChIKey of 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
The InChIKey is HMXXBEXNCBWIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N7O.C18H22N6O.C14H15ClN6.C10H13N4.3CH3.Sn/c1-12(2)22-18-16-14(4-5-19-18)24(3)23-17(16)13-10-15(21-11-20-13)25-6-8-26-9-7-25;1-12(2)23-18-16-13(3-4-19-18)10-20-17(16)14-9-15(22-11-21-14)24-5-7-25-8-6-24;1-8(2)19-14-12-10(4-5-16-14)21(3)20-13(12)9-6-11(15)18-7-17-9;1-7(2)13-10-8-6-12-14(3)9(8)4-5-11-10;;;;/h4-5,10-12H,6-9H2,1-3H3,(H,19,22);3-4,9,11-12H,5-8,10H2,1-2H3,(H,19,23);4-8H,1-3H3,(H,16,19);4-5,7H,1-3H3,(H,11,13);3*1H3;.
What are the key properties of 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine has a molecular weight of 1347.67 g/mol, XLogP of 9.19, 14 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-chloropyrimidin-4-yl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-N-propan-2-yl-3-trimethylstannylpyrazolo[4,3-c]pyridin-4-amine;3-(6-morpholin-4-ylpyrimidin-4-yl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine is sourced from PubChem (CID 158527246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).