N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide

C12H19NO — CID 14993078

IUPACN-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide
SMILESC=C(C)C1CC=C(C)C(NC(C)=O)C1
InChIInChI=1S/C12H19NO/c1-8(2)11-6-5-9(3)12(7-11)13-10(4)14/h5,11-12H,1,6-7H2,2-4H3,(H,13,14)
InChIKeyGLOVOGSNFFJSQI-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.42
Rot. Bonds2

About N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide

N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide (PubChem CID 14993078) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide
PubChem CID14993078
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide
SMILESC=C(C)C1CC=C(C)C(NC(C)=O)C1
InChIInChI=1S/C12H19NO/c1-8(2)11-6-5-9(3)12(7-11)13-10(4)14/h5,11-12H,1,6-7H2,2-4H3,(H,13,14)
InChIKeyGLOVOGSNFFJSQI-UHFFFAOYSA-N
XLogP2.42
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-((1R,5S)-2-methyl-5-(2-propionamidopropan-2-yl)cyclohex-2-en-1-yl)propionamide
CID 658528
(E)-4-methyl-N-(2-methylcyclohexyl)pent-2-enamide
CID 57527781
(2E)-5,9-dimethyl-N-octyldeca-2,8-dienamide
CID 44561506
N-(2-cyclohexen-1-yl)acetamide
CID 10219472
N-cyclobutyl-N'-{[(4S)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methyl}ethanediamide
CID 167714471
N-{1-methyl-1-[4-methyl-5-(propanoylamino)cyclohex-3-enyl]ethyl}propanamide
CID 3555054
N-[2-(cyclohexen-1-yl)ethyl]propanamide
CID 5226821
N-[(1R,4S,6R)-6-cyano-2,4-dimethylcyclohex-2-en-1-yl]acetamide
CID 101332364
N-(1-(5-(Acetylamino)-4-methyl-3-cyclohexen-1-yl)-1-methylethyl)acetamide
CID 375998
(1S)-N-cycloheptylcyclohex-3-ene-1-carboxamide
CID 51926176
N-[(1S)-3-methyl-1-(1-pent-2-ynyl-3,6-dihydro-2H-pyridin-5-yl)butyl]acetamide
CID 95127927
N-[1-[(2,6-dimethylcyclohex-2-en-1-yl)methyl]azetidin-3-yl]acetamide
CID 121570421

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide?
The IUPAC name of N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide (CID 14993078) is N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide.
What is the SMILES notation for N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide?
The canonical SMILES for N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide is C=C(C)C1CC=C(C)C(NC(C)=O)C1.
What is the InChIKey of N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide?
The InChIKey is GLOVOGSNFFJSQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-8(2)11-6-5-9(3)12(7-11)13-10(4)14/h5,11-12H,1,6-7H2,2-4H3,(H,13,14).
What are the key properties of N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide?
N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide has a molecular weight of 193.29 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl)acetamide is sourced from PubChem (CID 14993078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).