2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide

C16H27NO2 — CID 65121375

IUPAC2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
SMILESCCC1CCC(O)(CNC(=O)CC2C=CCC2)CC1
InChIInChI=1S/C16H27NO2/c1-2-13-7-9-16(19,10-8-13)12-17-15(18)11-14-5-3-4-6-14/h3,5,13-14,19H,2,4,6-12H2,1H3,(H,17,18)
InChIKeySQSLGAOSAIZHBI-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.79
Rot. Bonds5

About 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide

2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide (PubChem CID 65121375) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
PubChem CID65121375
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
SMILESCCC1CCC(O)(CNC(=O)CC2C=CCC2)CC1
InChIInChI=1S/C16H27NO2/c1-2-13-7-9-16(19,10-8-13)12-17-15(18)11-14-5-3-4-6-14/h3,5,13-14,19H,2,4,6-12H2,1H3,(H,17,18)
InChIKeySQSLGAOSAIZHBI-UHFFFAOYSA-N
XLogP2.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(1R)-cyclopent-2-en-1-yl]-N-[[(3S)-3-hydroxyoxolan-3-yl]methyl]acetamide
CID 97243038
4-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-4-oxobutanoic acid
CID 65117218
2-(cyclopentylamino)-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
CID 65120006
3-amino-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]butanamide
CID 65118910
2-[(1S)-cyclopent-2-en-1-yl]-N-[[(1R,3R)-3-ethoxy-1-hydroxy-2,2-dimethylcyclobutyl]methyl]acetamide
CID 124623493
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-3-(propan-2-ylamino)propanamide
CID 65119958
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide
CID 80722817
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 65124264
2-cyclopent-2-en-1-yl-N-(2-ethyl-2-hydroxybutyl)acetamide
CID 65113826
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-piperidin-4-ylsulfanylacetamide
CID 114627683
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]cyclopentanecarboxamide
CID 65121763
2-(2-chlorophenyl)-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
CID 65121812

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide (CID 65121375) is 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide is CCC1CCC(O)(CNC(=O)CC2C=CCC2)CC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
The InChIKey is SQSLGAOSAIZHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-2-13-7-9-16(19,10-8-13)12-17-15(18)11-14-5-3-4-6-14/h3,5,13-14,19H,2,4,6-12H2,1H3,(H,17,18).
What are the key properties of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide has a molecular weight of 265.40 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide is sourced from PubChem (CID 65121375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).