N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide

C17H21NO2S — CID 60605702

IUPACN-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide
SMILESCOc1ccc(C(NC(=O)c2ccc(C)s2)C(C)C)cc1
InChIInChI=1S/C17H21NO2S/c1-11(2)16(13-6-8-14(20-4)9-7-13)18-17(19)15-10-5-12(3)21-15/h5-11,16H,1-4H3,(H,18,19)
InChIKeyAHAWCPXLRCBMSO-UHFFFAOYSA-N
MW303.43 g/mol
LogP4.19
Rot. Bonds5

About N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide

N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide (PubChem CID 60605702) has the molecular formula C17H21NO2S and a molecular weight of 303.43 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide
PubChem CID60605702
Molecular FormulaC17H21NO2S
Molecular Weight303.43 g/mol
Exact Mass303.13
IUPAC NameN-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide
SMILESCOc1ccc(C(NC(=O)c2ccc(C)s2)C(C)C)cc1
InChIInChI=1S/C17H21NO2S/c1-11(2)16(13-6-8-14(20-4)9-7-13)18-17(19)15-10-5-12(3)21-15/h5-11,16H,1-4H3,(H,18,19)
InChIKeyAHAWCPXLRCBMSO-UHFFFAOYSA-N
XLogP4.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-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-[cyclopropyl-(4-methoxyphenyl)methyl]-5-methylthiophene-2-carboxamide
CID 42925486
3,5-dimethoxy-N-[1-(4-methoxyphenyl)-2-methylpropyl]-4-methylbenzamide
CID 55395267
N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
CID 51287944
N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]furan-2-carboxamide
CID 40938970
4-(aminomethyl)-N-[1-(4-methoxyphenyl)-2-methylpropyl]benzamide;hydrochloride
CID 119273373
N-[(4-methoxyphenyl)methyl]-5-methylthiophene-2-carboxamide
CID 7959658
4-acetamido-N-[1-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 22107827
2-fluoro-N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 9048819
4-ethoxy-N-[1-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 74613821
3-amino-N-[1-(4-methoxyphenyl)-2-methylpropyl]butanamide;hydrochloride
CID 119693493
3-amino-N-[1-(4-methoxyphenyl)-2-methylpropyl]propanamide;hydrochloride
CID 119273367
2,5-dichloro-N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 27830567

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide (CID 60605702) is N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide is COc1ccc(C(NC(=O)c2ccc(C)s2)C(C)C)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide?
The InChIKey is AHAWCPXLRCBMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2S/c1-11(2)16(13-6-8-14(20-4)9-7-13)18-17(19)15-10-5-12(3)21-15/h5-11,16H,1-4H3,(H,18,19).
What are the key properties of N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide?
N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide has a molecular weight of 303.43 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)-2-methylpropyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 60605702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).