N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

C15H26ClNO — CID 106443971

IUPACN-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)NC2CCCC2Cl)CCCC1
InChIInChI=1S/C15H26ClNO/c1-11(2)10-15(8-3-4-9-15)14(18)17-13-7-5-6-12(13)16/h11-13H,3-10H2,1-2H3,(H,17,18)
InChIKeyJIHOEEIZZJCXDW-UHFFFAOYSA-N
MW271.83 g/mol
LogP3.87
Rot. Bonds4

About N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (PubChem CID 106443971) has the molecular formula C15H26ClNO and a molecular weight of 271.83 g/mol. Its IUPAC name is N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
PubChem CID106443971
Molecular FormulaC15H26ClNO
Molecular Weight271.83 g/mol
Exact Mass271.17
IUPAC NameN-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)NC2CCCC2Cl)CCCC1
InChIInChI=1S/C15H26ClNO/c1-11(2)10-15(8-3-4-9-15)14(18)17-13-7-5-6-12(13)16/h11-13H,3-10H2,1-2H3,(H,17,18)
InChIKeyJIHOEEIZZJCXDW-UHFFFAOYSA-N
XLogP3.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.83
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-[(2-chlorocyclopentyl)methyl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 113272943
N-(4-chloropentan-2-yl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 113376732
N-[(2S)-1-aminopropan-2-yl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 120504549
2-methyl-1-[1-(2-methylpropyl)cyclohexyl]propan-1-one
CID 58210371
N-(2-amino-1-cyclopropylethyl)-1-(2-methylpropyl)cyclobutane-1-carboxamide;hydrochloride
CID 119613969
N-[1-(bromomethyl)-4-methylcyclohexyl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 114315007
N-but-3-yn-2-yl-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 114390037
N-[(2R)-2-chlorocyclohexyl]acetamide
CID 18526491
methyl 1-(2-methylpropyl)cyclohexane-1-carboxylate
CID 125474845
N-(4-hydroxy-2,2-dimethylbutyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 103825192
S-ethyl N-[(1R,2R)-2-chlorocyclohexyl]carbamothioate
CID 51415768
S-ethyl N-[(2S)-2-chlorocyclohexyl]carbamothioate
CID 18529331

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (CID 106443971) is N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is CC(C)CC1(C(=O)NC2CCCC2Cl)CCCC1.
What is the InChIKey of N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The InChIKey is JIHOEEIZZJCXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26ClNO/c1-11(2)10-15(8-3-4-9-15)14(18)17-13-7-5-6-12(13)16/h11-13H,3-10H2,1-2H3,(H,17,18).
What are the key properties of N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide has a molecular weight of 271.83 g/mol, XLogP of 3.87, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorocyclopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 106443971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).