3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide

C20H26N2OS — CID 110620228

IUPAC3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide
SMILESCc1nc(CCNC(=O)CC(c2ccc(C)c(C)c2)C2CC2)cs1
InChIInChI=1S/C20H26N2OS/c1-13-4-5-17(10-14(13)2)19(16-6-7-16)11-20(23)21-9-8-18-12-24-15(3)22-18/h4-5,10,12,16,19H,6-9,11H2,1-3H3,(H,21,23)
InChIKeyRFULXBWBOSNWBB-UHFFFAOYSA-N
MW342.51 g/mol
LogP4.31
Rot. Bonds7

About 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide

3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide (PubChem CID 110620228) has the molecular formula C20H26N2OS and a molecular weight of 342.51 g/mol. Its IUPAC name is 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide
PubChem CID110620228
Molecular FormulaC20H26N2OS
Molecular Weight342.51 g/mol
Exact Mass342.18
IUPAC Name3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide
SMILESCc1nc(CCNC(=O)CC(c2ccc(C)c(C)c2)C2CC2)cs1
InChIInChI=1S/C20H26N2OS/c1-13-4-5-17(10-14(13)2)19(16-6-7-16)11-20(23)21-9-8-18-12-24-15(3)22-18/h4-5,10,12,16,19H,6-9,11H2,1-3H3,(H,21,23)
InChIKeyRFULXBWBOSNWBB-UHFFFAOYSA-N
XLogP4.31
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.51
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide 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

3-cyclopropyl-3-(4-methoxy-3-methylphenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
CID 110310845
3-cyclopropyl-3-phenyl-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]propanamide
CID 110305224
3-cyclopropyl-3-(4-fluoro-3-methylphenyl)-N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]propanamide
CID 110307573
N-(4-acetamidophenyl)-3-cyclopropyl-3-(3,4-dimethylphenyl)propanamide
CID 110423890
3-cyclopropyl-3-(3,4-dimethylphenyl)propanamide
CID 82079052
3-cyclopropyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]propanamide
CID 110305047
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 77059141
3-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)propanamide
CID 110407527
1,5-di(cyclobutyl)-1,5-bis(3,4-dimethylphenyl)pentan-3-one
CID 73011541
1,5-dicyclopentyl-1,5-bis(3,4-dimethylphenyl)pentan-3-one
CID 73011666
2-amino-2-(4-methylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide;dihydrochloride
CID 120669527
3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-phenylpropanamide
CID 110620271

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide?
The IUPAC name of 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide (CID 110620228) is 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide.
What is the SMILES notation for 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide?
The canonical SMILES for 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide is Cc1nc(CCNC(=O)CC(c2ccc(C)c(C)c2)C2CC2)cs1.
What is the InChIKey of 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide?
The InChIKey is RFULXBWBOSNWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2OS/c1-13-4-5-17(10-14(13)2)19(16-6-7-16)11-20(23)21-9-8-18-12-24-15(3)22-18/h4-5,10,12,16,19H,6-9,11H2,1-3H3,(H,21,23).
What are the key properties of 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide?
3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide has a molecular weight of 342.51 g/mol, XLogP of 4.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-3-(3,4-dimethylphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]propanamide is sourced from PubChem (CID 110620228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).