2-chloro-N-cyclopentyl-N-propan-2-ylacetamide

C10H18ClNO — CID 54592476

IUPAC2-chloro-N-cyclopentyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)CCl)C1CCCC1
InChIInChI=1S/C10H18ClNO/c1-8(2)12(10(13)7-11)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3
InChIKeyHYUOJAMLEBGBOR-UHFFFAOYSA-N
MW203.71 g/mol
LogP2.40
Rot. Bonds3

About 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide

2-chloro-N-cyclopentyl-N-propan-2-ylacetamide (PubChem CID 54592476) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-chloro-N-cyclopentyl-N-propan-2-ylacetamide
PubChem CID54592476
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name2-chloro-N-cyclopentyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)CCl)C1CCCC1
InChIInChI=1S/C10H18ClNO/c1-8(2)12(10(13)7-11)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3
InChIKeyHYUOJAMLEBGBOR-UHFFFAOYSA-N
XLogP2.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 52.40
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

2-chloro-N-(1-methylpiperidin-3-yl)-N-propan-2-ylacetamide
CID 66565766
4-amino-N-cyclopentyl-N-propan-2-ylpentanamide
CID 120560450
N,N'-dicyclohexyl-N,N'-di(propan-2-yl)dodecanediamide
CID 20752266
4-amino-N-cyclopentyl-N-propan-2-ylbutanamide
CID 119291427
4-amino-N-cyclobutyl-N-propan-2-ylpentanamide;hydrochloride
CID 120563247
2-chloro-N-cyclohexyl-N-(2-hydroxypropyl)acetamide
CID 154848803
2-(1-aminopropan-2-ylsulfanyl)-N-cyclohexyl-N-propan-2-ylacetamide
CID 66217378
3-[2-[cyclohexyl(propan-2-yl)amino]-2-oxoethyl]sulfanylpropanoic acid
CID 43092591
N-cyclohexyl-2-(4-methylcyclohexyl)oxy-N-propan-2-ylacetamide
CID 140621937
N-cyclohexyl-2-[ethyl(pyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
CID 63299179
N-cyclohexyl-2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-propan-2-ylacetamide
CID 78963297
1-[2-[cyclopentyl(propan-2-yl)amino]-2-oxoethyl]pyrrolidine-3-carboxylic acid
CID 119904470

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide?
The IUPAC name of 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide (CID 54592476) is 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide is CC(C)N(C(=O)CCl)C1CCCC1.
What is the InChIKey of 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide?
The InChIKey is HYUOJAMLEBGBOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-8(2)12(10(13)7-11)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide?
2-chloro-N-cyclopentyl-N-propan-2-ylacetamide has a molecular weight of 203.71 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclopentyl-N-propan-2-ylacetamide is sourced from PubChem (CID 54592476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).