N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide

C15H24N2OS — CID 119568060

IUPACN-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide
SMILESCc1ccc(CCCC(=O)NC2(CN)CCCC2)s1
InChIInChI=1S/C15H24N2OS/c1-12-7-8-13(19-12)5-4-6-14(18)17-15(11-16)9-2-3-10-15/h7-8H,2-6,9-11,16H2,1H3,(H,17,18)
InChIKeyOGFMFAHMULIUSH-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.77
Rot. Bonds6

About N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide

N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide (PubChem CID 119568060) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide
PubChem CID119568060
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide
SMILESCc1ccc(CCCC(=O)NC2(CN)CCCC2)s1
InChIInChI=1S/C15H24N2OS/c1-12-7-8-13(19-12)5-4-6-14(18)17-15(11-16)9-2-3-10-15/h7-8H,2-6,9-11,16H2,1H3,(H,17,18)
InChIKeyOGFMFAHMULIUSH-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-4-(5-bromothiophen-2-yl)butanamide
CID 119568116
N-[1-(aminomethyl)cyclopentyl]-4-phenylbutanamide
CID 63754522
N-[(1-hydroxycyclobutyl)methyl]-4-(5-methylthiophen-2-yl)butanamide
CID 111859435
N-[1-(aminomethyl)cyclopentyl]-3-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 119565360
N-[1-(aminomethyl)cyclopentyl]-4-methylsulfanylbutanamide
CID 119568496
N-[3-(methylamino)propyl]-4-(5-methylthiophen-2-yl)butanamide;hydrochloride
CID 119433722
N-[1-(aminomethyl)cyclopentyl]-5-methylsulfanylpentanamide
CID 119565662
N-[1-(aminomethyl)cyclopentyl]-2-(5-bromothiophen-2-yl)acetamide
CID 119568476
4-(5-methylthiophen-2-yl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119514194
N-[1-(aminomethyl)cyclopentyl]-5-methoxypentanamide;hydrochloride
CID 119567009
N-[1-(aminomethyl)cyclopentyl]-4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)butanamide;hydrochloride
CID 119567894
N-[1-(aminomethyl)cyclopentyl]-2-(5-bromothiophen-2-yl)acetamide;hydrochloride
CID 119568475

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide (CID 119568060) is N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide is Cc1ccc(CCCC(=O)NC2(CN)CCCC2)s1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide?
The InChIKey is OGFMFAHMULIUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-12-7-8-13(19-12)5-4-6-14(18)17-15(11-16)9-2-3-10-15/h7-8H,2-6,9-11,16H2,1H3,(H,17,18).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide?
N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide has a molecular weight of 280.44 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-4-(5-methylthiophen-2-yl)butanamide is sourced from PubChem (CID 119568060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).