N-cyclopentyl-2-methylbutanamide;methane

C12H27NO — CID 159941857

IUPACN-cyclopentyl-2-methylbutanamide;methane
SMILESC.C.CCC(C)C(=O)NC1CCCC1
InChIInChI=1S/C10H19NO.2CH4/c1-3-8(2)10(12)11-9-6-4-5-7-9;;/h8-9H,3-7H2,1-2H3,(H,11,12);2*1H4
InChIKeyOAZDSLKNTYRNCI-UHFFFAOYSA-N
MW201.35 g/mol
LogP3.36
Rot. Bonds3

About N-cyclopentyl-2-methylbutanamide;methane

N-cyclopentyl-2-methylbutanamide;methane (PubChem CID 159941857) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is N-cyclopentyl-2-methylbutanamide;methane.

Molecular Properties

Compound NameN-cyclopentyl-2-methylbutanamide;methane
PubChem CID159941857
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC NameN-cyclopentyl-2-methylbutanamide;methane
SMILESC.C.CCC(C)C(=O)NC1CCCC1
InChIInChI=1S/C10H19NO.2CH4/c1-3-8(2)10(12)11-9-6-4-5-7-9;;/h8-9H,3-7H2,1-2H3,(H,11,12);2*1H4
InChIKeyOAZDSLKNTYRNCI-UHFFFAOYSA-N
XLogP3.36
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-N-cyclobutyl-2-methylbutanamide
CID 129182523
N-cycloheptyl-2-methylpentanamide
CID 4532030
N-cyclohexyl-2-methyl-3-(methylamino)propanamide
CID 79195893
N-cycloheptyl-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674669
N-cyclobutyl-3-(ethylamino)-2-methylpropanamide
CID 62839829
[3-(cyclohexylamino)-2-methyl-3-oxopropyl]-trifluoroboranuide
CID 54589865
N-[(1S,2S)-2-hydroxycyclohexyl]-2-methylbutanamide
CID 104957388
N-[(1R,2R)-2-aminocyclohexyl]-2-methylbutanamide
CID 103805727
N-cyclopentyl-2-(3-methylpentan-2-ylamino)propanamide
CID 54950797
N-(azetidin-3-yl)-2-methylbutanamide
CID 66188169
(2S)-2-methyl-N-[(1R,3R)-3-(trifluoromethyl)cyclohexyl]butanamide
CID 100835824
N-cyclopentyl-2-(3-ethylpentan-2-ylamino)acetamide
CID 55260185

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methylbutanamide;methane?
The IUPAC name of N-cyclopentyl-2-methylbutanamide;methane (CID 159941857) is N-cyclopentyl-2-methylbutanamide;methane.
What is the SMILES notation for N-cyclopentyl-2-methylbutanamide;methane?
The canonical SMILES for N-cyclopentyl-2-methylbutanamide;methane is C.C.CCC(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methylbutanamide;methane?
The InChIKey is OAZDSLKNTYRNCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.2CH4/c1-3-8(2)10(12)11-9-6-4-5-7-9;;/h8-9H,3-7H2,1-2H3,(H,11,12);2*1H4.
What are the key properties of N-cyclopentyl-2-methylbutanamide;methane?
N-cyclopentyl-2-methylbutanamide;methane has a molecular weight of 201.35 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methylbutanamide;methane is sourced from PubChem (CID 159941857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).