2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide

C9H7ClN4O2 — CID 115569525

IUPAC2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide
SMILESCc1nnc(NC(=O)c2cccnc2Cl)o1
InChIInChI=1S/C9H7ClN4O2/c1-5-13-14-9(16-5)12-8(15)6-3-2-4-11-7(6)10/h2-4H,1H3,(H,12,14,15)
InChIKeyAWANTPLWKBOGBI-UHFFFAOYSA-N
MW238.63 g/mol
LogP1.68
Rot. Bonds2

About 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide

2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide (PubChem CID 115569525) has the molecular formula C9H7ClN4O2 and a molecular weight of 238.63 g/mol. Its IUPAC name is 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide
PubChem CID115569525
Molecular FormulaC9H7ClN4O2
Molecular Weight238.63 g/mol
Exact Mass238.03
IUPAC Name2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide
SMILESCc1nnc(NC(=O)c2cccnc2Cl)o1
InChIInChI=1S/C9H7ClN4O2/c1-5-13-14-9(16-5)12-8(15)6-3-2-4-11-7(6)10/h2-4H,1H3,(H,12,14,15)
InChIKeyAWANTPLWKBOGBI-UHFFFAOYSA-N
XLogP1.68
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.63
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

1-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)isoquinoline-4-carboxamide
CID 106766417
2-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 43547697
2-[(2-chloropyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 114036719
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
CID 103892911
2,6-dihydroxy-N-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 107689655
3-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-4-carboxamide
CID 105071356
N-acetyl-2-chloropyridine-3-carboxamide
CID 61215997
2-chloro-N-(2-methyltetrazol-5-yl)pyridine-3-carboxamide
CID 938393
2-chloro-N-(3-methyl-1,2,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 115661246
2-chloro-N-(5-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 103738978
2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
CID 61041355
2-chloro-N-(2-methoxy-4-methylphenyl)pyridine-3-carboxamide
CID 61042493

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide (CID 115569525) is 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide is Cc1nnc(NC(=O)c2cccnc2Cl)o1.
What is the InChIKey of 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is AWANTPLWKBOGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN4O2/c1-5-13-14-9(16-5)12-8(15)6-3-2-4-11-7(6)10/h2-4H,1H3,(H,12,14,15).
What are the key properties of 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide?
2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 238.63 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 115569525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).