4-chloro-N-(2-cyclopentylethyl)butanamide

C11H20ClNO — CID 63307990

IUPAC4-chloro-N-(2-cyclopentylethyl)butanamide
SMILESO=C(CCCCl)NCCC1CCCC1
InChIInChI=1S/C11H20ClNO/c12-8-3-6-11(14)13-9-7-10-4-1-2-5-10/h10H,1-9H2,(H,13,14)
InChIKeyJOYVMQTYWNPOCI-UHFFFAOYSA-N
MW217.74 g/mol
LogP2.70
Rot. Bonds6

About 4-chloro-N-(2-cyclopentylethyl)butanamide

4-chloro-N-(2-cyclopentylethyl)butanamide (PubChem CID 63307990) has the molecular formula C11H20ClNO and a molecular weight of 217.74 g/mol. Its IUPAC name is 4-chloro-N-(2-cyclopentylethyl)butanamide.

Molecular Properties

Compound Name4-chloro-N-(2-cyclopentylethyl)butanamide
PubChem CID63307990
Molecular FormulaC11H20ClNO
Molecular Weight217.74 g/mol
Exact Mass217.12
IUPAC Name4-chloro-N-(2-cyclopentylethyl)butanamide
SMILESO=C(CCCCl)NCCC1CCCC1
InChIInChI=1S/C11H20ClNO/c12-8-3-6-11(14)13-9-7-10-4-1-2-5-10/h10H,1-9H2,(H,13,14)
InChIKeyJOYVMQTYWNPOCI-UHFFFAOYSA-N
XLogP2.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.74
LogP ≤ 52.70
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

4-chloro-N-(3-cyclopentylpropyl)butanamide
CID 106009634
N-(2-chloroethyl)-3-cyclohexylpropanamide
CID 61288292
2-chloro-N-(2-cyclobutylethyl)acetamide
CID 115879965
4-(2-cyclohexylethylamino)-4-oxobutanoic acid
CID 60919559
3-cyclopentyl-N-[7-(3-cyclopentylpropanoylamino)heptyl]propanamide
CID 5183874
N-(2-cyclopropylethyl)-4-hydroxybutanamide
CID 79192412
5-amino-N-(2-cyclopentylethyl)hexanamide
CID 82852565
4-chloro-N-(2-cyclopentyloxyethyl)butanamide
CID 63828950
3-(4-cyclohexylbutanoylamino)propanoic acid
CID 43241269
N-(3-aminopropyl)-4-cyclopentylbutanamide
CID 119409090
N-(2-cyclopentylethyl)-4-(4-methylphenyl)butanamide
CID 55774639
6-(4-cyclopentylbutanoylamino)hexanoic acid
CID 119220158

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-cyclopentylethyl)butanamide?
The IUPAC name of 4-chloro-N-(2-cyclopentylethyl)butanamide (CID 63307990) is 4-chloro-N-(2-cyclopentylethyl)butanamide.
What is the SMILES notation for 4-chloro-N-(2-cyclopentylethyl)butanamide?
The canonical SMILES for 4-chloro-N-(2-cyclopentylethyl)butanamide is O=C(CCCCl)NCCC1CCCC1.
What is the InChIKey of 4-chloro-N-(2-cyclopentylethyl)butanamide?
The InChIKey is JOYVMQTYWNPOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO/c12-8-3-6-11(14)13-9-7-10-4-1-2-5-10/h10H,1-9H2,(H,13,14).
What are the key properties of 4-chloro-N-(2-cyclopentylethyl)butanamide?
4-chloro-N-(2-cyclopentylethyl)butanamide has a molecular weight of 217.74 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-cyclopentylethyl)butanamide is sourced from PubChem (CID 63307990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).