2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide

C15H30N2O — CID 102906008

IUPAC2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide
SMILESCC(C)C(CNC(=O)C1CCCC1CN)C(C)C
InChIInChI=1S/C15H30N2O/c1-10(2)14(11(3)4)9-17-15(18)13-7-5-6-12(13)8-16/h10-14H,5-9,16H2,1-4H3,(H,17,18)
InChIKeyXFMARONSNQVFOE-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.41
Rot. Bonds6

About 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide

2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide (PubChem CID 102906008) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide
PubChem CID102906008
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide
SMILESCC(C)C(CNC(=O)C1CCCC1CN)C(C)C
InChIInChI=1S/C15H30N2O/c1-10(2)14(11(3)4)9-17-15(18)13-7-5-6-12(13)8-16/h10-14H,5-9,16H2,1-4H3,(H,17,18)
InChIKeyXFMARONSNQVFOE-UHFFFAOYSA-N
XLogP2.41
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide
CID 113269315
2-(aminomethyl)-N-[2-(2-methylpropylamino)-2-oxoethyl]cyclopentane-1-carboxamide
CID 112702833
4-[[2-(aminomethyl)cyclohexanecarbonyl]amino]-3-methylbutanoic acid
CID 81073388
4-[[2-(aminomethyl)cyclopentanecarbonyl]amino]-2-methylbutanoic acid
CID 80539395
2-(aminomethyl)-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide
CID 115747505
1-[(1R,2S)-2-(aminomethyl)cyclopentyl]ethanone
CID 131112690
2-(aminomethyl)-N-[3-[methyl(propan-2-yl)amino]propyl]cyclohexane-1-carboxamide
CID 106047668
3-[[2-(aminomethyl)cyclohexanecarbonyl]amino]-2-hydroxy-2-methylpropanoic acid
CID 66175768
2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexane-1-carboxamide
CID 79363022
2-(aminomethyl)-N-(4-hydroxy-2,2-dimethylbutyl)cyclopentane-1-carboxamide
CID 106148063
2-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]cyclohexane-1-carboxamide
CID 81386609
2-(aminomethyl)-N-(5-hydroxypentyl)cyclopentane-1-carboxamide
CID 107317629

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide (CID 102906008) is 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide is CC(C)C(CNC(=O)C1CCCC1CN)C(C)C.
What is the InChIKey of 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide?
The InChIKey is XFMARONSNQVFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-10(2)14(11(3)4)9-17-15(18)13-7-5-6-12(13)8-16/h10-14H,5-9,16H2,1-4H3,(H,17,18).
What are the key properties of 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide?
2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide has a molecular weight of 254.42 g/mol, XLogP of 2.41, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 102906008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).