3-chloro-N-cyclopentyl-N-ethylpropanamide

C10H18ClNO — CID 43541097

IUPAC3-chloro-N-cyclopentyl-N-ethylpropanamide
SMILESCCN(C(=O)CCCl)C1CCCC1
InChIInChI=1S/C10H18ClNO/c1-2-12(10(13)7-8-11)9-5-3-4-6-9/h9H,2-8H2,1H3
InChIKeyVAVGOWCPFSYHSP-UHFFFAOYSA-N
MW203.71 g/mol
LogP2.41
Rot. Bonds4

About 3-chloro-N-cyclopentyl-N-ethylpropanamide

3-chloro-N-cyclopentyl-N-ethylpropanamide (PubChem CID 43541097) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is 3-chloro-N-cyclopentyl-N-ethylpropanamide.

Molecular Properties

Compound Name3-chloro-N-cyclopentyl-N-ethylpropanamide
PubChem CID43541097
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name3-chloro-N-cyclopentyl-N-ethylpropanamide
SMILESCCN(C(=O)CCCl)C1CCCC1
InChIInChI=1S/C10H18ClNO/c1-2-12(10(13)7-8-11)9-5-3-4-6-9/h9H,2-8H2,1H3
InChIKeyVAVGOWCPFSYHSP-UHFFFAOYSA-N
XLogP2.41
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 52.41
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

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3-amino-N-cyclohexyl-N-ethylpropanamide
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N-cyclopentyl-N-ethyl-3-(ethylamino)propanamide
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N-cyclopentyl-N-ethylcarbamoyl chloride
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N-(3-chloropropyl)-N-cyclobutylbutanamide
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N-(2-chloroethyl)-N-cyclohexyloctanamide
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N-cyclohexyl-N-ethyl-3-phenylpropanamide
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ethyl 2-[3-chloropropanoyl(cyclopropyl)amino]acetate
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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-cyclopentyl-N-ethylpropanamide?
The IUPAC name of 3-chloro-N-cyclopentyl-N-ethylpropanamide (CID 43541097) is 3-chloro-N-cyclopentyl-N-ethylpropanamide.
What is the SMILES notation for 3-chloro-N-cyclopentyl-N-ethylpropanamide?
The canonical SMILES for 3-chloro-N-cyclopentyl-N-ethylpropanamide is CCN(C(=O)CCCl)C1CCCC1.
What is the InChIKey of 3-chloro-N-cyclopentyl-N-ethylpropanamide?
The InChIKey is VAVGOWCPFSYHSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-2-12(10(13)7-8-11)9-5-3-4-6-9/h9H,2-8H2,1H3.
What are the key properties of 3-chloro-N-cyclopentyl-N-ethylpropanamide?
3-chloro-N-cyclopentyl-N-ethylpropanamide has a molecular weight of 203.71 g/mol, XLogP of 2.41, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclopentyl-N-ethylpropanamide is sourced from PubChem (CID 43541097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).