(5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide

C15H15ClN6O — CID 129474537

IUPAC(5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
SMILESN#Cc1cnc(NC[C@@H]2CCn3ncc(C(N)=O)c3C2)c(Cl)c1
InChIInChI=1S/C15H15ClN6O/c16-12-3-10(5-17)7-20-15(12)19-6-9-1-2-22-13(4-9)11(8-21-22)14(18)23/h3,7-9H,1-2,4,6H2,(H2,18,23)(H,19,20)/t9-/m1/s1
InChIKeyNHNJSZHWRSSZSM-SECBINFHSA-N
MW330.78 g/mol
LogP1.58
Rot. Bonds4

About (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide

(5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 129474537) has the molecular formula C15H15ClN6O and a molecular weight of 330.78 g/mol. Its IUPAC name is (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name(5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID129474537
Molecular FormulaC15H15ClN6O
Molecular Weight330.78 g/mol
Exact Mass330.10
IUPAC Name(5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
SMILESN#Cc1cnc(NC[C@@H]2CCn3ncc(C(N)=O)c3C2)c(Cl)c1
InChIInChI=1S/C15H15ClN6O/c16-12-3-10(5-17)7-20-15(12)19-6-9-1-2-22-13(4-9)11(8-21-22)14(18)23/h3,7-9H,1-2,4,6H2,(H2,18,23)(H,19,20)/t9-/m1/s1
InChIKeyNHNJSZHWRSSZSM-SECBINFHSA-N
XLogP1.58
TPSA109.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.78
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide with MolForge

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Related Compounds

5-chloro-6-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methylamino]pyridine-3-carbonitrile
CID 129473044
5-[[(3-phenylmethoxyphenyl)methylamino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 128974725
(5S)-5-[[(4-cyanobenzoyl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 129325025
(5S)-5-(acetamidomethyl)-N-(5-cyano-2-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 129479402
(5S)-5-[[(2-ethoxy-5-nitrophenyl)methylamino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 129473237
(5S)-5-[[(3-bromo-4-methoxyphenyl)methylamino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 100630985
5-(acetamidomethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 112756606
5-chloro-6-(2-hydroxyethylamino)pyridine-3-carbonitrile
CID 58554205
5-[[(5-cyano-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 128994391
[5-[[(6-ethyl-5-fluoropyrimidin-4-yl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone
CID 154754441
tert-butyl 2-[(3-chloro-5-cyano-2-pyridinyl)amino]acetate
CID 58554110
5-[[[amino(diethylamino)methylidene]amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 120662690

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide (CID 129474537) is (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide is N#Cc1cnc(NC[C@@H]2CCn3ncc(C(N)=O)c3C2)c(Cl)c1.
What is the InChIKey of (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is NHNJSZHWRSSZSM-SECBINFHSA-N. The full InChI is InChI=1S/C15H15ClN6O/c16-12-3-10(5-17)7-20-15(12)19-6-9-1-2-22-13(4-9)11(8-21-22)14(18)23/h3,7-9H,1-2,4,6H2,(H2,18,23)(H,19,20)/t9-/m1/s1.
What are the key properties of (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
(5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 330.78 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[[(3-chloro-5-cyano-2-pyridinyl)amino]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 129474537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).