N-cycloheptylthiophene-2-carboxamide

C12H17NOS — CID 2057917

IUPACN-cycloheptylthiophene-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1cccs1
InChIInChI=1S/C12H17NOS/c14-12(11-8-5-9-15-11)13-10-6-3-1-2-4-7-10/h5,8-10H,1-4,6-7H2,(H,13,14)
InChIKeyIBKIQVVJWVPWSB-UHFFFAOYSA-N
MW223.34 g/mol
LogP3.20
Rot. Bonds2

About N-cycloheptylthiophene-2-carboxamide

N-cycloheptylthiophene-2-carboxamide (PubChem CID 2057917) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is N-cycloheptylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptylthiophene-2-carboxamide
PubChem CID2057917
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC NameN-cycloheptylthiophene-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1cccs1
InChIInChI=1S/C12H17NOS/c14-12(11-8-5-9-15-11)13-10-6-3-1-2-4-7-10/h5,8-10H,1-4,6-7H2,(H,13,14)
InChIKeyIBKIQVVJWVPWSB-UHFFFAOYSA-N
XLogP3.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cycloheptylthiophene-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-cyclohexylthiophene-2-carboxamide
CID 855035
N-(2-ethylhexyl)-2-thiophenecarboxamide
CID 2915198
N-cyclopentyl-5-methylthiophene-2-carboxamide
CID 2373236
N-(2-Phenylethyl)-2-thiophenecarboxamide
CID 728650
N-(1-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 1245731
N-(1,1-dioxidotetrahydrothiophen-3-yl)thiophene-2-carboxamide
CID 2891912
N-cyclooctylthiophene-2-carboxamide
CID 673377
N-cycloheptyl-4-oxo-4-thiophen-2-ylbutanamide
CID 2364189
N-(1-Methyl-2-(1-piperidinyl)ethyl)-2-thiophenecarboxamide
CID 2971109
5-methyl-N-(1-pyrrolidin-1-yl-1-thiophen-2-ylpropan-2-yl)thiophene-2-carboxamide
CID 3573521
N-(2,3-dimethylcyclohexyl)-2-thienylcarboxamide
CID 4072672
N-[2-[(4-methylcyclohexyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 16389189

Frequently Asked Questions

What is the IUPAC name of N-cycloheptylthiophene-2-carboxamide?
The IUPAC name of N-cycloheptylthiophene-2-carboxamide (CID 2057917) is N-cycloheptylthiophene-2-carboxamide.
What is the SMILES notation for N-cycloheptylthiophene-2-carboxamide?
The canonical SMILES for N-cycloheptylthiophene-2-carboxamide is O=C(NC1CCCCCC1)c1cccs1.
What is the InChIKey of N-cycloheptylthiophene-2-carboxamide?
The InChIKey is IBKIQVVJWVPWSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c14-12(11-8-5-9-15-11)13-10-6-3-1-2-4-7-10/h5,8-10H,1-4,6-7H2,(H,13,14).
What are the key properties of N-cycloheptylthiophene-2-carboxamide?
N-cycloheptylthiophene-2-carboxamide has a molecular weight of 223.34 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptylthiophene-2-carboxamide is sourced from PubChem (CID 2057917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).