2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide

C15H17N3O2S — CID 51080423

IUPAC2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide
SMILESCN(Cc1ccsc1)C(=O)Nc1ccccc1CC(N)=O
InChIInChI=1S/C15H17N3O2S/c1-18(9-11-6-7-21-10-11)15(20)17-13-5-3-2-4-12(13)8-14(16)19/h2-7,10H,8-9H2,1H3,(H2,16,19)(H,17,20)
InChIKeyVPMQUHXXVLKSGB-UHFFFAOYSA-N
MW303.39 g/mol
LogP2.44
Rot. Bonds5

About 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide

2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide (PubChem CID 51080423) has the molecular formula C15H17N3O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide
PubChem CID51080423
Molecular FormulaC15H17N3O2S
Molecular Weight303.39 g/mol
Exact Mass303.10
IUPAC Name2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide
SMILESCN(Cc1ccsc1)C(=O)Nc1ccccc1CC(N)=O
InChIInChI=1S/C15H17N3O2S/c1-18(9-11-6-7-21-10-11)15(20)17-13-5-3-2-4-12(13)8-14(16)19/h2-7,10H,8-9H2,1H3,(H2,16,19)(H,17,20)
InChIKeyVPMQUHXXVLKSGB-UHFFFAOYSA-N
XLogP2.44
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide 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

1-methyl-3-naphthalen-1-yl-1-(thiophen-3-ylmethyl)urea
CID 17467272
1-methyl-3-propan-2-yl-1-(thiophen-3-ylmethyl)urea
CID 53016506
2-[2-[[(2-amino-2-oxoethyl)-methylcarbamoyl]amino]phenyl]acetic acid
CID 62536518
N-(2-ethylphenyl)-2-thiophen-3-ylacetamide
CID 7750935
1-methyl-3-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)-1-(thiophen-3-ylmethyl)urea
CID 47050439
2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)benzamide
CID 62167817
3-[4-(1-hydroxyethyl)phenyl]-1-methyl-1-(thiophen-3-ylmethyl)urea
CID 61341427
3-bromo-2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]benzoic acid
CID 63113712
3-butyl-1-methyl-1-(thiophen-3-ylmethyl)urea
CID 115574006
N-[3-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]cyclopropanecarboxamide
CID 47033602
1-methyl-3-[3-[1-(methylamino)ethyl]phenyl]-1-(thiophen-3-ylmethyl)urea
CID 61340217
3-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]butanoic acid
CID 61197737

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide?
The IUPAC name of 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide (CID 51080423) is 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide.
What is the SMILES notation for 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide?
The canonical SMILES for 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide is CN(Cc1ccsc1)C(=O)Nc1ccccc1CC(N)=O.
What is the InChIKey of 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide?
The InChIKey is VPMQUHXXVLKSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2S/c1-18(9-11-6-7-21-10-11)15(20)17-13-5-3-2-4-12(13)8-14(16)19/h2-7,10H,8-9H2,1H3,(H2,16,19)(H,17,20).
What are the key properties of 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide?
2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide has a molecular weight of 303.39 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]phenyl]acetamide is sourced from PubChem (CID 51080423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).