2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide

C12H24N2O — CID 142811143

IUPAC2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide
SMILESCC(C)C(N)C(=O)NC1CC(C)[C@@H](C)C1
InChIInChI=1S/C12H24N2O/c1-7(2)11(13)12(15)14-10-5-8(3)9(4)6-10/h7-11H,5-6,13H2,1-4H3,(H,14,15)/t8-,9?,10?,11?/m0/s1
InChIKeyPZPFNZHDXPWRTJ-FBAUCUACSA-N
MW212.34 g/mol
LogP1.52
Rot. Bonds3

About 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide

2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide (PubChem CID 142811143) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide
PubChem CID142811143
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide
SMILESCC(C)C(N)C(=O)NC1CC(C)[C@@H](C)C1
InChIInChI=1S/C12H24N2O/c1-7(2)11(13)12(15)14-10-5-8(3)9(4)6-10/h7-11H,5-6,13H2,1-4H3,(H,14,15)/t8-,9?,10?,11?/m0/s1
InChIKeyPZPFNZHDXPWRTJ-FBAUCUACSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]cyclopentanecarboxamide
CID 90674949
N-[(2S)-1-[[2-(ethylamino)-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]cyclopentanecarboxamide
CID 90674950
N-Cyclopentyl L-isoleucinamide
CID 24703639
(2S)-2-amino-N-hexyl-3-methylbutanamide
CID 53855464
(R)-2-Amino-N-(cyclohexylmethyl)-3-methylbutanamide
CID 54757478
Valeramide, N-cyclopentyl-2-propyl-
CID 211205
(2S,3S)-2-amino-N-cyclopentyl-3-methylpentanamide
CID 10821834
1-amino-N-ethylcyclopentane-1-carboxamide
CID 60866844
2-amino-N-(cyclopentylmethyl)-2-methylpropanamide
CID 61266758
N'-[(2S)-butan-2-yl]-N-(2-cyclopentylethyl)oxamide
CID 7326757
N-[1-(tert-butylamino)-1-oxopropan-2-yl]cyclopentanecarboxamide
CID 47323556
(S)-2-amino-4-methyl-N-octylpentanamide
CID 83299787

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide?
The IUPAC name of 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide (CID 142811143) is 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide.
What is the SMILES notation for 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide?
The canonical SMILES for 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide is CC(C)C(N)C(=O)NC1CC(C)[C@@H](C)C1.
What is the InChIKey of 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide?
The InChIKey is PZPFNZHDXPWRTJ-FBAUCUACSA-N. The full InChI is InChI=1S/C12H24N2O/c1-7(2)11(13)12(15)14-10-5-8(3)9(4)6-10/h7-11H,5-6,13H2,1-4H3,(H,14,15)/t8-,9?,10?,11?/m0/s1.
What are the key properties of 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide?
2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide has a molecular weight of 212.34 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(3S)-3,4-dimethylcyclopentyl]-3-methylbutanamide is sourced from PubChem (CID 142811143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).