N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide

C15H12N4OS — CID 40547504

IUPACN-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
SMILESNc1nc(-c2ccc(NC(=O)c3cccnc3)cc2)cs1
InChIInChI=1S/C15H12N4OS/c16-15-19-13(9-21-15)10-3-5-12(6-4-10)18-14(20)11-2-1-7-17-8-11/h1-9H,(H2,16,19)(H,18,20)
InChIKeyCYUHQLJNESZHGW-UHFFFAOYSA-N
MW296.36 g/mol
LogP3.04
Rot. Bonds3

About N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide

N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide (PubChem CID 40547504) has the molecular formula C15H12N4OS and a molecular weight of 296.36 g/mol. Its IUPAC name is N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
PubChem CID40547504
Molecular FormulaC15H12N4OS
Molecular Weight296.36 g/mol
Exact Mass296.07
IUPAC NameN-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
SMILESNc1nc(-c2ccc(NC(=O)c3cccnc3)cc2)cs1
InChIInChI=1S/C15H12N4OS/c16-15-19-13(9-21-15)10-3-5-12(6-4-10)18-14(20)11-2-1-7-17-8-11/h1-9H,(H2,16,19)(H,18,20)
InChIKeyCYUHQLJNESZHGW-UHFFFAOYSA-N
XLogP3.04
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(pyridine-3-carbonylamino)phenyl]-1,3-thiazole-4-carboxylic acid
CID 39163969
N-[4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 31263128
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-2-chlorobenzamide
CID 28865171
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-3,5-dimethoxybenzamide
CID 28865073
N-[3-[4-(2-amino-1,3-thiazol-4-yl)anilino]-3-oxopropyl]-N-(2,3-dihydro-1H-inden-2-yl)pyridine-3-carboxamide
CID 5272470
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-2-fluorobenzamide
CID 28865020
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-3,4-dimethoxybenzamide
CID 23102404
N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide
CID 1358652
N-(4-fluorophenyl)pyridine-3-carboxamide;hydrochloride
CID 110756411
4-acetamido-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 2463732
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propanamide
CID 896768

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide (CID 40547504) is N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide is Nc1nc(-c2ccc(NC(=O)c3cccnc3)cc2)cs1.
What is the InChIKey of N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
The InChIKey is CYUHQLJNESZHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4OS/c16-15-19-13(9-21-15)10-3-5-12(6-4-10)18-14(20)11-2-1-7-17-8-11/h1-9H,(H2,16,19)(H,18,20).
What are the key properties of N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide?
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide has a molecular weight of 296.36 g/mol, XLogP of 3.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 40547504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).