2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide

C14H12F2N2OS — CID 110694430

IUPAC2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(C2CC2)sc1C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C14H12F2N2OS/c1-7-12(20-14(17-7)8-5-6-8)13(19)18-11-9(15)3-2-4-10(11)16/h2-4,8H,5-6H2,1H3,(H,18,19)
InChIKeyQCJNHWOMTHNIDH-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.86
Rot. Bonds3

About 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide

2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 110694430) has the molecular formula C14H12F2N2OS and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID110694430
Molecular FormulaC14H12F2N2OS
Molecular Weight294.33 g/mol
Exact Mass294.06
IUPAC Name2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(C2CC2)sc1C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C14H12F2N2OS/c1-7-12(20-14(17-7)8-5-6-8)13(19)18-11-9(15)3-2-4-10(11)16/h2-4,8H,5-6H2,1H3,(H,18,19)
InChIKeyQCJNHWOMTHNIDH-UHFFFAOYSA-N
XLogP3.86
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-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

2-cyclopropyl-4-methyl-N-(3-methylphenyl)-1,3-thiazole-5-carboxamide
CID 110694378
2-(3-chlorophenyl)-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 60599394
N-(5-chloro-2-methoxyphenyl)-2-cyclopropyl-4-methyl-1,3-thiazole-5-carboxamide
CID 110694390
2-[2-[(2-cyclopentyl-4-methyl-1,3-thiazole-5-carbonyl)amino]phenyl]acetic acid
CID 119218384
N-butyl-2-cyclopropyl-4-methyl-1,3-thiazole-5-carboxamide
CID 110694293
N-(2,6-difluorophenyl)-2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 134044579
2-cyclopropyl-4-methyl-N-(pyridin-4-ylmethyl)-1,3-thiazole-5-carboxamide
CID 110694330
2-[3-[(2-cyclopentyl-4-methyl-1,3-thiazole-5-carbonyl)amino]phenoxy]acetic acid
CID 119224780
N-(2,6-difluorophenyl)-2,5-dimethyl-1,3-thiazole-4-carboxamide
CID 110465586
[(2S)-1-(2,6-difluoroanilino)-1-oxopropan-2-yl] 2,4-dimethyl-1,3-thiazole-5-carboxylate
CID 8578454
2-cyclopentyl-4-methyl-N-[2-(methylamino)ethyl]-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119503859
2-cyclobutyl-4-methyl-1,3-thiazole-5-carboxylic acid
CID 64982497

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide (CID 110694430) is 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide is Cc1nc(C2CC2)sc1C(=O)Nc1c(F)cccc1F.
What is the InChIKey of 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is QCJNHWOMTHNIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2OS/c1-7-12(20-14(17-7)8-5-6-8)13(19)18-11-9(15)3-2-4-10(11)16/h2-4,8H,5-6H2,1H3,(H,18,19).
What are the key properties of 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide?
2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 294.33 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2,6-difluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 110694430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).