1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide

C15H24N2OS — CID 115435212

IUPAC1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide
SMILESCCCC(NC(=O)C1(CN)CCCC1)c1cccs1
InChIInChI=1S/C15H24N2OS/c1-2-6-12(13-7-5-10-19-13)17-14(18)15(11-16)8-3-4-9-15/h5,7,10,12H,2-4,6,8-9,11,16H2,1H3,(H,17,18)
InChIKeyPFELCPDTIYHHSI-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.22
Rot. Bonds6

About 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide

1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide (PubChem CID 115435212) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide
PubChem CID115435212
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide
SMILESCCCC(NC(=O)C1(CN)CCCC1)c1cccs1
InChIInChI=1S/C15H24N2OS/c1-2-6-12(13-7-5-10-19-13)17-14(18)15(11-16)8-3-4-9-15/h5,7,10,12H,2-4,6,8-9,11,16H2,1H3,(H,17,18)
InChIKeyPFELCPDTIYHHSI-UHFFFAOYSA-N
XLogP3.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-4-methyl-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide
CID 115441973
1-carbamothioyl-N-(1-thiophen-2-ylbutyl)cyclobutane-1-carboxamide
CID 80589308
4-(aminomethyl)-N-(1-thiophen-2-ylethyl)oxane-4-carboxamide
CID 113310086
2-(aminomethyl)-N-(1-thiophen-2-ylbutyl)butanamide
CID 65229248
5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide
CID 104684884
1-(aminomethyl)-N-(1-thiophen-2-ylpropan-2-yl)cyclobutane-1-carboxamide
CID 113311585
1-cyano-3-methyl-N-(1-thiophen-2-ylbutyl)cyclobutane-1-carboxamide
CID 80599692
3-amino-3-sulfanylidene-N-(1-thiophen-2-ylbutyl)propanamide
CID 55134581
3-oxo-3-(1-thiophen-2-ylbutylamino)propanoic acid
CID 62231148
2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
CID 103515707
2-[1-(1-thiophen-2-ylbutylcarbamoylamino)cyclobutyl]acetic acid
CID 79842245
1-(aminomethyl)-N-[1-(1,3-thiazol-2-yl)propyl]cyclohexane-1-carboxamide
CID 115437914

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide (CID 115435212) is 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide is CCCC(NC(=O)C1(CN)CCCC1)c1cccs1.
What is the InChIKey of 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide?
The InChIKey is PFELCPDTIYHHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-2-6-12(13-7-5-10-19-13)17-14(18)15(11-16)8-3-4-9-15/h5,7,10,12H,2-4,6,8-9,11,16H2,1H3,(H,17,18).
What are the key properties of 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide?
1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide has a molecular weight of 280.44 g/mol, XLogP of 3.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 115435212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).