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

C11H20ClNO2 — CID 63828950

IUPAC4-chloro-N-(2-cyclopentyloxyethyl)butanamide
SMILESO=C(CCCCl)NCCOC1CCCC1
InChIInChI=1S/C11H20ClNO2/c12-7-3-6-11(14)13-8-9-15-10-4-1-2-5-10/h10H,1-9H2,(H,13,14)
InChIKeyVRHOGXWDYNSHFX-UHFFFAOYSA-N
MW233.74 g/mol
LogP2.08
Rot. Bonds7

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

4-chloro-N-(2-cyclopentyloxyethyl)butanamide (PubChem CID 63828950) has the molecular formula C11H20ClNO2 and a molecular weight of 233.74 g/mol. Its IUPAC name is 4-chloro-N-(2-cyclopentyloxyethyl)butanamide.

Molecular Properties

Compound Name4-chloro-N-(2-cyclopentyloxyethyl)butanamide
PubChem CID63828950
Molecular FormulaC11H20ClNO2
Molecular Weight233.74 g/mol
Exact Mass233.12
IUPAC Name4-chloro-N-(2-cyclopentyloxyethyl)butanamide
SMILESO=C(CCCCl)NCCOC1CCCC1
InChIInChI=1S/C11H20ClNO2/c12-7-3-6-11(14)13-8-9-15-10-4-1-2-5-10/h10H,1-9H2,(H,13,14)
InChIKeyVRHOGXWDYNSHFX-UHFFFAOYSA-N
XLogP2.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-(2-cycloheptyloxyethyl)butanamide;hydrochloride
CID 119325380
N-(2-cyclopentyloxyethyl)-3-sulfanylpropanamide
CID 107030121
N-(2-cyclohexyloxyethyl)-3-(cyclopropylamino)propanamide
CID 63827585
4-chloro-N-(2-cyclopentylethyl)butanamide
CID 63307990
ethyl 4-(2-cyclopentyloxyethylamino)-4-oxobutanoate
CID 61150779
4-chloro-N-(3-cyclopentylpropyl)butanamide
CID 106009634
3-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275390
tert-butyl 4-(2-cyclopentyloxyethylamino)-4-oxobutanoate
CID 106707456
N-(3-cyclopentyloxypropyl)-4,4,4-trifluorobutanamide
CID 131949460
6-amino-N-(2-cyclopentyloxyethyl)-4,4-dimethylhexanamide
CID 65291239
N-(2-cyclohexyloxyethyl)-2-(cyclopropylmethylamino)acetamide
CID 63826704
2-cyano-N-(2-cyclohexyloxyethyl)acetamide
CID 63828131

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-cyclopentyloxyethyl)butanamide?
The IUPAC name of 4-chloro-N-(2-cyclopentyloxyethyl)butanamide (CID 63828950) is 4-chloro-N-(2-cyclopentyloxyethyl)butanamide.
What is the SMILES notation for 4-chloro-N-(2-cyclopentyloxyethyl)butanamide?
The canonical SMILES for 4-chloro-N-(2-cyclopentyloxyethyl)butanamide is O=C(CCCCl)NCCOC1CCCC1.
What is the InChIKey of 4-chloro-N-(2-cyclopentyloxyethyl)butanamide?
The InChIKey is VRHOGXWDYNSHFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO2/c12-7-3-6-11(14)13-8-9-15-10-4-1-2-5-10/h10H,1-9H2,(H,13,14).
What are the key properties of 4-chloro-N-(2-cyclopentyloxyethyl)butanamide?
4-chloro-N-(2-cyclopentyloxyethyl)butanamide has a molecular weight of 233.74 g/mol, XLogP of 2.08, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-cyclopentyloxyethyl)butanamide is sourced from PubChem (CID 63828950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).