4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide

C15H15ClN4O3 — CID 154838990

IUPAC4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide
SMILESCc1noc(C2CC2)c1NC(=O)CNC(=O)c1cc(Cl)ccn1
InChIInChI=1S/C15H15ClN4O3/c1-8-13(14(23-20-8)9-2-3-9)19-12(21)7-18-15(22)11-6-10(16)4-5-17-11/h4-6,9H,2-3,7H2,1H3,(H,18,22)(H,19,21)
InChIKeyVXNPMYZJJMKZTL-UHFFFAOYSA-N
MW334.76 g/mol
LogP2.28
Rot. Bonds5

About 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide

4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide (PubChem CID 154838990) has the molecular formula C15H15ClN4O3 and a molecular weight of 334.76 g/mol. Its IUPAC name is 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide
PubChem CID154838990
Molecular FormulaC15H15ClN4O3
Molecular Weight334.76 g/mol
Exact Mass334.08
IUPAC Name4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide
SMILESCc1noc(C2CC2)c1NC(=O)CNC(=O)c1cc(Cl)ccn1
InChIInChI=1S/C15H15ClN4O3/c1-8-13(14(23-20-8)9-2-3-9)19-12(21)7-18-15(22)11-6-10(16)4-5-17-11/h4-6,9H,2-3,7H2,1H3,(H,18,22)(H,19,21)
InChIKeyVXNPMYZJJMKZTL-UHFFFAOYSA-N
XLogP2.28
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.76
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide with MolForge

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Related Compounds

4-chloro-N-[2-(cyclopropylmethylamino)-2-oxoethyl]pyridine-2-carboxamide
CID 24667080
4-chloro-N-[2-(4-chloroanilino)-2-oxoethyl]pyridine-2-carboxamide
CID 9068732
4-chloro-N-[2-(3-methylanilino)-2-oxoethyl]pyridine-2-carboxamide
CID 9039107
4-chloro-N-[2-oxo-2-(4-propylanilino)ethyl]pyridine-2-carboxamide
CID 9225392
N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-3-(3,5-dimethylphenyl)propanamide
CID 75484697
4-chloro-N-[2-[2-(4-methylbenzoyl)hydrazinyl]-2-oxoethyl]pyridine-2-carboxamide
CID 9366395
4-chloro-N-[2-(naphthalen-2-ylamino)-2-oxoethyl]pyridine-2-carboxamide
CID 9068575
4-chloro-N-[2-[(4-methylpiperazin-1-yl)amino]-2-oxoethyl]pyridine-2-carboxamide
CID 9205834
methyl 3-[[2-[(4-chloropyridine-2-carbonyl)amino]acetyl]amino]-4-methylbenzoate
CID 9378201
4-chloro-N-[2-[4-methyl-3-(methylsulfamoyl)anilino]-2-oxoethyl]pyridine-2-carboxamide
CID 9479430
4-chloro-N-[2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl]pyridine-2-carboxamide
CID 9268867
N-[2-[2-(4-tert-butylbenzoyl)hydrazinyl]-2-oxoethyl]-4-chloropyridine-2-carboxamide
CID 9327506

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide (CID 154838990) is 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide is Cc1noc(C2CC2)c1NC(=O)CNC(=O)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide?
The InChIKey is VXNPMYZJJMKZTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN4O3/c1-8-13(14(23-20-8)9-2-3-9)19-12(21)7-18-15(22)11-6-10(16)4-5-17-11/h4-6,9H,2-3,7H2,1H3,(H,18,22)(H,19,21).
What are the key properties of 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide?
4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide has a molecular weight of 334.76 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)amino]-2-oxoethyl]pyridine-2-carboxamide is sourced from PubChem (CID 154838990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).