5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide

C11H20ClNO2 — CID 102861187

IUPAC5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide
SMILESO=C(CCCCCl)N(CCO)C1CCC1
InChIInChI=1S/C11H20ClNO2/c12-7-2-1-6-11(15)13(8-9-14)10-4-3-5-10/h10,14H,1-9H2
InChIKeyNZHCQYGQLWXKML-UHFFFAOYSA-N
MW233.74 g/mol
LogP1.77
Rot. Bonds7

About 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide

5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide (PubChem CID 102861187) has the molecular formula C11H20ClNO2 and a molecular weight of 233.74 g/mol. Its IUPAC name is 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide.

Molecular Properties

Compound Name5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide
PubChem CID102861187
Molecular FormulaC11H20ClNO2
Molecular Weight233.74 g/mol
Exact Mass233.12
IUPAC Name5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide
SMILESO=C(CCCCCl)N(CCO)C1CCC1
InChIInChI=1S/C11H20ClNO2/c12-7-2-1-6-11(15)13(8-9-14)10-4-3-5-10/h10,14H,1-9H2
InChIKeyNZHCQYGQLWXKML-UHFFFAOYSA-N
XLogP1.77
TPSA40.54 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 ≤ 51.77
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

6-[cyclohexyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 54875131
N-cyclobutyl-N-(2-hydroxyethyl)-4-(methylamino)butanamide
CID 102862127
3-bromo-N-cyclobutyl-N-(2-hydroxyethyl)propanamide
CID 102861214
N-(3-chloropropyl)-N-cyclobutylbutanamide
CID 102872148
N-cyclopentyl-N-(2-hydroxyethyl)-4-(methylamino)butanamide
CID 60953691
N-(2-chloroethyl)-N-cyclohexyloctanamide
CID 63391554
5-[cyclopropyl(2-hydroxyethyl)amino]-5-oxopentanoic acid
CID 43578459
N-cyclopentyl-N-(2-hydroxyethyl)-3-sulfanylpropanamide
CID 107026376
N-(2-chloroethyl)-N-cyclopropylnonanamide
CID 65426813
5-amino-N-cyclobutyl-N-(3-hydroxypropyl)pentanamide
CID 102861717
N-cyclobutyl-N-(3-hydroxypropyl)decanamide
CID 102866665
4-chloro-N-cyclohexyl-N-ethylbutanamide
CID 13048749

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide?
The IUPAC name of 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide (CID 102861187) is 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide.
What is the SMILES notation for 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide?
The canonical SMILES for 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide is O=C(CCCCCl)N(CCO)C1CCC1.
What is the InChIKey of 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide?
The InChIKey is NZHCQYGQLWXKML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO2/c12-7-2-1-6-11(15)13(8-9-14)10-4-3-5-10/h10,14H,1-9H2.
What are the key properties of 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide?
5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide has a molecular weight of 233.74 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)pentanamide is sourced from PubChem (CID 102861187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).