N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide

C11H20ClNO — CID 107184308

IUPACN-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)N(C)C(C)CCl
InChIInChI=1S/C11H20ClNO/c1-8-5-4-6-10(8)11(14)13(3)9(2)7-12/h8-10H,4-7H2,1-3H3
InChIKeyWVQZNYMOZWTKOA-UHFFFAOYSA-N
MW217.74 g/mol
LogP2.51
Rot. Bonds3

About N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide

N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide (PubChem CID 107184308) has the molecular formula C11H20ClNO and a molecular weight of 217.74 g/mol. Its IUPAC name is N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide
PubChem CID107184308
Molecular FormulaC11H20ClNO
Molecular Weight217.74 g/mol
Exact Mass217.12
IUPAC NameN-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)N(C)C(C)CCl
InChIInChI=1S/C11H20ClNO/c1-8-5-4-6-10(8)11(14)13(3)9(2)7-12/h8-10H,4-7H2,1-3H3
InChIKeyWVQZNYMOZWTKOA-UHFFFAOYSA-N
XLogP2.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.74
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(1-chloropropan-2-yl)-N-methylcyclobutanecarboxamide
CID 104555934
N-(1-chloropropan-2-yl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 104555749
N-(1-chloropropan-2-yl)-N-methylcyclooctanecarboxamide
CID 104555564
N-(2-amino-1-cyclopropylethyl)-N,2-dimethylcyclopentane-1-carboxamide
CID 107181073
N-(3-chloropropyl)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 107183830
2-amino-N-(1-methoxypropan-2-yl)-N,3-dimethylcyclohexane-1-carboxamide
CID 62783255
N-(2-chloroethyl)-N-cyclopropyl-2-methylcyclopentane-1-carboxamide
CID 107183874
N-(1-chloropropan-2-yl)-4,4-difluoro-N-methylcyclohexane-1-carboxamide
CID 104555904
N-(1-chloropropan-2-yl)-N-methyl-1,1-dioxothiane-2-carboxamide
CID 104555649
2-[(2-methylcyclopentanecarbonyl)-(2-methylpropyl)amino]acetic acid
CID 107175437
N-(1-chloropropan-2-yl)-N,2,2,3,3-pentamethylcyclopropane-1-carboxamide
CID 104555692
3-amino-N,2-dimethyl-N-(4-methylpentan-2-yl)cyclohexane-1-carboxamide
CID 55115501

Frequently Asked Questions

What is the IUPAC name of N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide?
The IUPAC name of N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide (CID 107184308) is N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide?
The canonical SMILES for N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide is CC1CCCC1C(=O)N(C)C(C)CCl.
What is the InChIKey of N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide?
The InChIKey is WVQZNYMOZWTKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO/c1-8-5-4-6-10(8)11(14)13(3)9(2)7-12/h8-10H,4-7H2,1-3H3.
What are the key properties of N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide?
N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide has a molecular weight of 217.74 g/mol, XLogP of 2.51, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-chloropropan-2-yl)-N,2-dimethylcyclopentane-1-carboxamide is sourced from PubChem (CID 107184308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).