3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine

C66H85ClN20O2Sn — CID 159725555

IUPAC3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine
SMILESCC(C)Nc1nccc2c1C(c1cc(N3CCOCC3)ccn1)=NC2.CC(C)Nc1nccc2c1c(-c1cc(Cl)ccn1)nn2C.CC(C)Nc1nccc2c1c(-c1cc(N3CCOCC3)ccn1)nn2C.CC(C)Nc1nccc2c1c([Sn](C)(C)C)nn2C
InChIInChI=1S/C19H24N6O.C19H23N5O.C15H16ClN5.C10H13N4.3CH3.Sn/c1-13(2)22-19-17-16(5-7-21-19)24(3)23-18(17)15-12-14(4-6-20-15)25-8-10-26-11-9-25;1-13(2)23-19-17-14(3-5-21-19)12-22-18(17)16-11-15(4-6-20-16)24-7-9-25-10-8-24;1-9(2)19-15-13-12(5-7-18-15)21(3)20-14(13)11-8-10(16)4-6-17-11;1-7(2)13-10-8-6-12-14(3)9(8)4-5-11-10;;;;/h4-7,12-13H,8-11H2,1-3H3,(H,21,22);3-6,11,13H,7-10,12H2,1-2H3,(H,21,23);4-9H,1-3H3,(H,18,19);4-5,7H,1-3H3,(H,11,13);3*1H3;
InChIKeyNAOXQDJLPVRZSS-UHFFFAOYSA-N
MW1344.71 g/mol
LogP11.01
Rot. Bonds14

About 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine

3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine (PubChem CID 159725555) has the molecular formula C66H85ClN20O2Sn and a molecular weight of 1344.71 g/mol. Its IUPAC name is 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine.

Molecular Properties

Compound Name3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine
PubChem CID159725555
Molecular FormulaC66H85ClN20O2Sn
Molecular Weight1344.71 g/mol
Exact Mass1344.59
IUPAC Name3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine
SMILESCC(C)Nc1nccc2c1C(c1cc(N3CCOCC3)ccn1)=NC2.CC(C)Nc1nccc2c1c(-c1cc(Cl)ccn1)nn2C.CC(C)Nc1nccc2c1c(-c1cc(N3CCOCC3)ccn1)nn2C.CC(C)Nc1nccc2c1c([Sn](C)(C)C)nn2C
InChIInChI=1S/C19H24N6O.C19H23N5O.C15H16ClN5.C10H13N4.3CH3.Sn/c1-13(2)22-19-17-16(5-7-21-19)24(3)23-18(17)15-12-14(4-6-20-15)25-8-10-26-11-9-25;1-13(2)23-19-17-14(3-5-21-19)12-22-18(17)16-11-15(4-6-20-16)24-7-9-25-10-8-24;1-9(2)19-15-13-12(5-7-18-15)21(3)20-14(13)11-8-10(16)4-6-17-11;1-7(2)13-10-8-6-12-14(3)9(8)4-5-11-10;;;;/h4-7,12-13H,8-11H2,1-3H3,(H,21,22);3-6,11,13H,7-10,12H2,1-2H3,(H,21,23);4-9H,1-3H3,(H,18,19);4-5,7H,1-3H3,(H,11,13);3*1H3;
InChIKeyNAOXQDJLPVRZSS-UHFFFAOYSA-N
XLogP11.01
TPSA229.11 Ų
H-Bond Donors4
H-Bond Acceptors22
Rotatable Bonds14
Heavy Atoms90
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001344.71
LogP ≤ 511.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1022

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

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
The IUPAC name of 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine (CID 159725555) is 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine.
What is the SMILES notation for 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
The canonical SMILES for 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine is CC(C)Nc1nccc2c1C(c1cc(N3CCOCC3)ccn1)=NC2.CC(C)Nc1nccc2c1c(-c1cc(Cl)ccn1)nn2C.CC(C)Nc1nccc2c1c(-c1cc(N3CCOCC3)ccn1)nn2C.CC(C)Nc1nccc2c1c([Sn](C)(C)C)nn2C.
What is the InChIKey of 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
The InChIKey is NAOXQDJLPVRZSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O.C19H23N5O.C15H16ClN5.C10H13N4.3CH3.Sn/c1-13(2)22-19-17-16(5-7-21-19)24(3)23-18(17)15-12-14(4-6-20-15)25-8-10-26-11-9-25;1-13(2)23-19-17-14(3-5-21-19)12-22-18(17)16-11-15(4-6-20-16)24-7-9-25-10-8-24;1-9(2)19-15-13-12(5-7-18-15)21(3)20-14(13)11-8-10(16)4-6-17-11;1-7(2)13-10-8-6-12-14(3)9(8)4-5-11-10;;;;/h4-7,12-13H,8-11H2,1-3H3,(H,21,22);3-6,11,13H,7-10,12H2,1-2H3,(H,21,23);4-9H,1-3H3,(H,18,19);4-5,7H,1-3H3,(H,11,13);3*1H3;.
What are the key properties of 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine?
3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine has a molecular weight of 1344.71 g/mol, XLogP of 11.01, 14 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-2-pyridinyl)-1-methyl-N-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine;1-methyl-3-(4-morpholin-4-yl-2-pyridinyl)-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-(4-morpholin-4-yl-2-pyridinyl)-N-propan-2-yl-1H-pyrrolo[3,4-c]pyridin-4-amine is sourced from PubChem (CID 159725555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).