N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide

C11H15NOS — CID 94169217

IUPACN-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NCC1CCC1
InChIInChI=1S/C11H15NOS/c1-8-5-6-14-10(8)11(13)12-7-9-3-2-4-9/h5-6,9H,2-4,7H2,1H3,(H,12,13)
InChIKeyPCBJZZVGBLLKQJ-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.59
Rot. Bonds3

About N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide

N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide (PubChem CID 94169217) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide
PubChem CID94169217
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC NameN-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NCC1CCC1
InChIInChI=1S/C11H15NOS/c1-8-5-6-14-10(8)11(13)12-7-9-3-2-4-9/h5-6,9H,2-4,7H2,1H3,(H,12,13)
InChIKeyPCBJZZVGBLLKQJ-UHFFFAOYSA-N
XLogP2.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(cyclobutylmethyl)-3-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

3-methyl-N-(pyrrolidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 71638244
3-methyl-N-(oxiran-2-ylmethyl)thiophene-2-carboxamide
CID 102548440
N-(cyclopentylmethyl)-3-(methoxymethyl)thiophene-2-carboxamide
CID 75448549
N-(cyclobutylmethyl)-3-(3-hydroxyprop-1-ynyl)thiophene-2-carboxamide
CID 55238972
N-[(4-hydroxypyrrolidin-3-yl)methyl]-3-methylthiophene-2-carboxamide;hydrochloride
CID 120944157
N-(aminomethyl)-3-methylthiophene-2-carboxamide
CID 169257485
3-amino-N-[(4-ethylcyclohexyl)methyl]thiophene-2-carboxamide
CID 61118488
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-3-methylthiophene-2-carboxamide
CID 65123688
N-[(3-bromocyclohexyl)methyl]-3-chlorothiophene-2-carboxamide
CID 106133249
3-[2-(cyclohexylmethylcarbamoyl)thiophen-3-yl]prop-2-enoic acid
CID 77007017
3-methyl-N-(2-methylprop-2-enyl)thiophene-2-carboxamide
CID 114618529
3-methyl-N-prop-2-ynylthiophene-2-carboxamide
CID 39911816

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide (CID 94169217) is N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide is Cc1ccsc1C(=O)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide?
The InChIKey is PCBJZZVGBLLKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c1-8-5-6-14-10(8)11(13)12-7-9-3-2-4-9/h5-6,9H,2-4,7H2,1H3,(H,12,13).
What are the key properties of N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide?
N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide has a molecular weight of 209.31 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-3-methylthiophene-2-carboxamide is sourced from PubChem (CID 94169217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).