N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide

C20H18N2OS — CID 3173507

IUPACN-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
SMILESO=C(C1CC1)N(Cc1ccccc1)c1nc(-c2ccccc2)cs1
InChIInChI=1S/C20H18N2OS/c23-19(17-11-12-17)22(13-15-7-3-1-4-8-15)20-21-18(14-24-20)16-9-5-2-6-10-16/h1-10,14,17H,11-13H2
InChIKeyFOINHSCTYXGAIY-UHFFFAOYSA-N
MW334.44 g/mol
LogP4.75
Rot. Bonds5

About N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide

N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide (PubChem CID 3173507) has the molecular formula C20H18N2OS and a molecular weight of 334.44 g/mol. Its IUPAC name is N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
PubChem CID3173507
Molecular FormulaC20H18N2OS
Molecular Weight334.44 g/mol
Exact Mass334.11
IUPAC NameN-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
SMILESO=C(C1CC1)N(Cc1ccccc1)c1nc(-c2ccccc2)cs1
InChIInChI=1S/C20H18N2OS/c23-19(17-11-12-17)22(13-15-7-3-1-4-8-15)20-21-18(14-24-20)16-9-5-2-6-10-16/h1-10,14,17H,11-13H2
InChIKeyFOINHSCTYXGAIY-UHFFFAOYSA-N
XLogP4.75
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.44
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide 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-benzyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 1138529
N-[3-(diethylamino)propyl]-N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;oxalic acid
CID 171667862
N-benzyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-pyrrolidin-1-ylacetamide
CID 25316258
[2-[benzyl-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] (1R,5R)-9-oxobicyclo[3.3.1]nonane-3-carboxylate
CID 98419712
N-benzyl-2-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide
CID 1175892
N-benzyl-4-methoxy-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 1172662
N-(2-phenylethyl)-N-(4-phenyl-1,3-thiazol-2-yl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 55557719
1-benzyl-5-oxo-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enylpyrrolidine-3-carboxamide
CID 18079930
[2-[benzyl-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] propanoate
CID 18230833
2-chloro-N-(oxolan-2-ylmethyl)-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 3173521
4-[[methyl-(4-phenyl-1,3-thiazol-2-yl)amino]methyl]benzoic acid
CID 67146644
N-benzyl-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-ethoxypropanamide
CID 56500554

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide (CID 3173507) is N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide is O=C(C1CC1)N(Cc1ccccc1)c1nc(-c2ccccc2)cs1.
What is the InChIKey of N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide?
The InChIKey is FOINHSCTYXGAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2OS/c23-19(17-11-12-17)22(13-15-7-3-1-4-8-15)20-21-18(14-24-20)16-9-5-2-6-10-16/h1-10,14,17H,11-13H2.
What are the key properties of N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide?
N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide has a molecular weight of 334.44 g/mol, XLogP of 4.75, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 3173507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).