N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide

C13H13ClN4O — CID 71813961

IUPACN-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1cc2n(n1)CCCC2
InChIInChI=1S/C13H13ClN4O/c14-9-4-5-12(15-8-9)16-13(19)11-7-10-3-1-2-6-18(10)17-11/h4-5,7-8H,1-3,6H2,(H,15,16,19)
InChIKeyWDRXDJHWZLRTMQ-UHFFFAOYSA-N
MW276.73 g/mol
LogP2.52
Rot. Bonds2

About N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide

N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 71813961) has the molecular formula C13H13ClN4O and a molecular weight of 276.73 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID71813961
Molecular FormulaC13H13ClN4O
Molecular Weight276.73 g/mol
Exact Mass276.08
IUPAC NameN-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1cc2n(n1)CCCC2
InChIInChI=1S/C13H13ClN4O/c14-9-4-5-12(15-8-9)16-13(19)11-7-10-3-1-2-6-18(10)17-11/h4-5,7-8H,1-3,6H2,(H,15,16,19)
InChIKeyWDRXDJHWZLRTMQ-UHFFFAOYSA-N
XLogP2.52
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.73
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide (CID 71813961) is N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide is O=C(Nc1ccc(Cl)cn1)c1cc2n(n1)CCCC2.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is WDRXDJHWZLRTMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4O/c14-9-4-5-12(15-8-9)16-13(19)11-7-10-3-1-2-6-18(10)17-11/h4-5,7-8H,1-3,6H2,(H,15,16,19).
What are the key properties of N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 276.73 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 71813961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).