3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide

C13H19NOS — CID 25162656

IUPAC3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NC1CCCCC1C
InChIInChI=1S/C13H19NOS/c1-9-5-3-4-6-11(9)14-13(15)12-10(2)7-8-16-12/h7-9,11H,3-6H2,1-2H3,(H,14,15)
InChIKeyPNMZMFDTBASFRG-UHFFFAOYSA-N
MW237.37 g/mol
LogP3.37
Rot. Bonds2

About 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide

3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide (PubChem CID 25162656) has the molecular formula C13H19NOS and a molecular weight of 237.37 g/mol. Its IUPAC name is 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide
PubChem CID25162656
Molecular FormulaC13H19NOS
Molecular Weight237.37 g/mol
Exact Mass237.12
IUPAC Name3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NC1CCCCC1C
InChIInChI=1S/C13H19NOS/c1-9-5-3-4-6-11(9)14-13(15)12-10(2)7-8-16-12/h7-9,11H,3-6H2,1-2H3,(H,14,15)
InChIKeyPNMZMFDTBASFRG-UHFFFAOYSA-N
XLogP3.37
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2S)-2-[(3-methylthiophene-2-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 97161349
N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride
CID 71638238
N-[2-(chloromethyl)cyclohexyl]-3-methylthiophene-2-carboxamide
CID 106366771
N-(2-cyanocyclopentyl)-3-methylthiophene-2-carboxamide
CID 62963070
3-methyl-N-[2-(piperidin-1-ylmethyl)cyclohexyl]thiophene-2-carboxamide
CID 140519163
3-[2-[(2-methylcyclopentyl)carbamoyl]thiophen-3-yl]prop-2-enoic acid
CID 77017621
3-iodo-N-(2-methylcyclobutyl)thiophene-2-carboxamide
CID 130576413
1-N,4-N-bis[(1S,2R)-2-methylcyclohexyl]benzene-1,4-dicarboxamide
CID 124805645
3-methyl-N-[(2R,3R)-2-(4-methylphenyl)oxan-3-yl]thiophene-2-carboxamide
CID 95964683
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
trans-(1S,3S)-3-[(3-methylthiophene-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 97318295
cis-(1R,2S)-2-[(3-ethylthiophene-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 97031564

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide?
The IUPAC name of 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide (CID 25162656) is 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide?
The canonical SMILES for 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide is Cc1ccsc1C(=O)NC1CCCCC1C.
What is the InChIKey of 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide?
The InChIKey is PNMZMFDTBASFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NOS/c1-9-5-3-4-6-11(9)14-13(15)12-10(2)7-8-16-12/h7-9,11H,3-6H2,1-2H3,(H,14,15).
What are the key properties of 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide?
3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide has a molecular weight of 237.37 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide is sourced from PubChem (CID 25162656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).