N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide

C19H18N2OS — CID 52529905

IUPACN-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide
SMILESCc1ncc(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)s1
InChIInChI=1S/C19H18N2OS/c1-14-20-13-18(23-14)19(22)21-17(16-10-6-3-7-11-16)12-15-8-4-2-5-9-15/h2-11,13,17H,12H2,1H3,(H,21,22)/t17-/m1/s1
InChIKeyAIYNCEICPKBLHD-QGZVFWFLSA-N
MW322.43 g/mol
LogP4.17
Rot. Bonds5

About N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide

N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide (PubChem CID 52529905) has the molecular formula C19H18N2OS and a molecular weight of 322.43 g/mol. Its IUPAC name is N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide
PubChem CID52529905
Molecular FormulaC19H18N2OS
Molecular Weight322.43 g/mol
Exact Mass322.11
IUPAC NameN-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide
SMILESCc1ncc(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)s1
InChIInChI=1S/C19H18N2OS/c1-14-20-13-18(23-14)19(22)21-17(16-10-6-3-7-11-16)12-15-8-4-2-5-9-15/h2-11,13,17H,12H2,1H3,(H,21,22)/t17-/m1/s1
InChIKeyAIYNCEICPKBLHD-QGZVFWFLSA-N
XLogP4.17
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.43
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1R)-1,2-diphenylethyl]-2-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

N-(1,2-diphenylethyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
CID 18193675
N-[1-[[1-[(4,5-dihydroxy-4-methyl-3-oxo-1-phenylpentan-2-yl)amino]-3-methoxy-1-oxopropan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide
CID 123873301
N-[1-[[1-[[(2S,4S)-5-chloro-4-hydroxy-4-methyl-3-oxo-1-phenylpentan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide
CID 90092517
N-[(2S)-1-[[(2S)-1-[[(2S)-4,5-dihydroxy-4-methyl-3-oxo-1-phenylpentan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide
CID 134212913
N-[1-[[(2S)-1-[[(2S,4R)-4,5-dihydroxy-4-methyl-3-oxo-1-phenylpentan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide
CID 142310736
2-methyl-N-(2-phenylethyl)-1,3-thiazole-5-carboxamide
CID 110852278
1-(1,2-diphenylethyl)-3-methylurea
CID 23548551
1,2-diphenylethylurea
CID 2853470
N-[(1R)-1,2-diphenylethyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 31348831
[(3R,5S)-5-[[(2S)-3-methoxy-2-[[(2S)-3-methoxy-2-[(2-methyl-1,3-thiazole-5-carbonyl)amino]propanoyl]amino]propanoyl]amino]-3-methyl-4-oxo-6-phenylhexan-3-yl] formate
CID 134212863
methyl N-(1,2-diphenylethyl)carbamate
CID 139785732
[(2R,4S)-2-hydroxy-4-[[(2S,5S)-6-methoxy-2-(methoxymethyl)-5-[(2-methyl-1,3-thiazole-5-carbonyl)amino]-4-oxohexanoyl]amino]-2-methyl-3-oxo-5-phenylpentyl] acetate
CID 149048158

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide (CID 52529905) is N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide is Cc1ncc(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)s1.
What is the InChIKey of N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is AIYNCEICPKBLHD-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H18N2OS/c1-14-20-13-18(23-14)19(22)21-17(16-10-6-3-7-11-16)12-15-8-4-2-5-9-15/h2-11,13,17H,12H2,1H3,(H,21,22)/t17-/m1/s1.
What are the key properties of N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide?
N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 322.43 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1,2-diphenylethyl]-2-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 52529905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).