1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide

C15H18N2OS — CID 81489454

IUPAC1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide
SMILESNCC1(C(=O)Nc2ccc3sccc3c2)CCCC1
InChIInChI=1S/C15H18N2OS/c16-10-15(6-1-2-7-15)14(18)17-12-3-4-13-11(9-12)5-8-19-13/h3-5,8-9H,1-2,6-7,10,16H2,(H,17,18)
InChIKeyXQDDRSVTOIQJGS-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.36
Rot. Bonds3

About 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide

1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide (PubChem CID 81489454) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide
PubChem CID81489454
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide
SMILESNCC1(C(=O)Nc2ccc3sccc3c2)CCCC1
InChIInChI=1S/C15H18N2OS/c16-10-15(6-1-2-7-15)14(18)17-12-3-4-13-11(9-12)5-8-19-13/h3-5,8-9H,1-2,6-7,10,16H2,(H,17,18)
InChIKeyXQDDRSVTOIQJGS-UHFFFAOYSA-N
XLogP3.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-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-(1-benzothiophen-5-yl)-3-propylpiperidine-3-carboxamide
CID 63130559
1-(aminomethyl)-N-(1H-indol-5-yl)cyclopentane-1-carboxamide
CID 81489854
1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide
CID 115183467
1-(aminomethyl)-N-(4-chloro-3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119708329
N-(1-benzothiophen-5-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242293
1-(aminomethyl)-N-(4-hydroxyphenyl)cyclohexane-1-carboxamide
CID 115437412
1-(aminomethyl)-N-[4-(carbamoylamino)phenyl]cyclohexane-1-carboxamide
CID 115437417
5-[[1-(aminomethyl)cyclopentanecarbonyl]amino]-2-fluorobenzoic acid
CID 115434908
1-(aminomethyl)-N-(4-bromo-3-fluorophenyl)cycloheptane-1-carboxamide
CID 115444172
1-(aminomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclobutane-1-carboxamide
CID 80588839
1-(aminomethyl)-N-(4-bromophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670345
1-(aminomethyl)-N-(3-fluoro-4-hydroxyphenyl)cyclobutane-1-carboxamide
CID 113311717

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide (CID 81489454) is 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide is NCC1(C(=O)Nc2ccc3sccc3c2)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide?
The InChIKey is XQDDRSVTOIQJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c16-10-15(6-1-2-7-15)14(18)17-12-3-4-13-11(9-12)5-8-19-13/h3-5,8-9H,1-2,6-7,10,16H2,(H,17,18).
What are the key properties of 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide?
1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide has a molecular weight of 274.39 g/mol, XLogP of 3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 81489454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).