N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide

C12H11N3OS — CID 110647283

IUPACN-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
SMILESO=C(NC1CC1)c1csc(-c2ccccn2)n1
InChIInChI=1S/C12H11N3OS/c16-11(14-8-4-5-8)10-7-17-12(15-10)9-3-1-2-6-13-9/h1-3,6-8H,4-5H2,(H,14,16)
InChIKeyRVDJYPCUSVHBDV-UHFFFAOYSA-N
MW245.31 g/mol
LogP2.10
Rot. Bonds3

About N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide

N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 110647283) has the molecular formula C12H11N3OS and a molecular weight of 245.31 g/mol. Its IUPAC name is N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
PubChem CID110647283
Molecular FormulaC12H11N3OS
Molecular Weight245.31 g/mol
Exact Mass245.06
IUPAC NameN-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
SMILESO=C(NC1CC1)c1csc(-c2ccccn2)n1
InChIInChI=1S/C12H11N3OS/c16-11(14-8-4-5-8)10-7-17-12(15-10)9-3-1-2-6-13-9/h1-3,6-8H,4-5H2,(H,14,16)
InChIKeyRVDJYPCUSVHBDV-UHFFFAOYSA-N
XLogP2.10
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
N-(4-hydroxycyclohexyl)-2-phenyl-1,3-thiazole-4-carboxamide
CID 78810994
N-cyclooctyl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 17449429
N-(4-acetamidophenyl)-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 48845320
4-[(2-phenyl-1,3-thiazole-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 119229160
N-[2-(dimethylamino)ethyl]-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 110647680
N-[1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]benzamide
CID 18142784
N-[3-(dimethylamino)propyl]-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 110647739
1-cyclohexyl-3-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]urea
CID 108784317
[(3R)-3-(methylamino)piperidin-1-yl]-(2-pyridin-2-yl-1,3-thiazol-4-yl)methanone
CID 124574925
2-(4-chlorophenyl)-N-cyclopropyl-1,3-thiazole-4-carboxamide
CID 26736860
N-cyclohexyl-4-pyridin-2-yl-1,3-thiazole-2-carboxamide
CID 83407453

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide (CID 110647283) is N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide is O=C(NC1CC1)c1csc(-c2ccccn2)n1.
What is the InChIKey of N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is RVDJYPCUSVHBDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3OS/c16-11(14-8-4-5-8)10-7-17-12(15-10)9-3-1-2-6-13-9/h1-3,6-8H,4-5H2,(H,14,16).
What are the key properties of N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide?
N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 245.31 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 110647283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).