N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide

C11H19NO2 — CID 115771738

IUPACN-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide
SMILESCCN(CCCO)C(=O)C1CC=CC1
InChIInChI=1S/C11H19NO2/c1-2-12(8-5-9-13)11(14)10-6-3-4-7-10/h3-4,10,13H,2,5-9H2,1H3
InChIKeyJRBLFTAGVHILSM-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.18
Rot. Bonds5

About N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide

N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide (PubChem CID 115771738) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide
PubChem CID115771738
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide
SMILESCCN(CCCO)C(=O)C1CC=CC1
InChIInChI=1S/C11H19NO2/c1-2-12(8-5-9-13)11(14)10-6-3-4-7-10/h3-4,10,13H,2,5-9H2,1H3
InChIKeyJRBLFTAGVHILSM-UHFFFAOYSA-N
XLogP1.18
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-hydroxy-N,N,7-trimethylnon-4-enamide
CID 91392114
N,N,N',N'-tetrakis(3-hydroxypropyl)-2-oct-1-enylbutanediamide
CID 141484962
1-(3-Hydroxypropyl)-3-prop-2-enylpyrrolidin-2-one
CID 141875080
3,6-diethyl-2-hydroxy-1,4-dimethyl-3,6-dihydro-2H-azepin-7-one
CID 143689645
(E)-8-hydroxy-N,N,7-trimethylnon-4-enamide
CID 143932155
1-(3-Hydroxypropyl)-3-pent-1-enylpyrrolidine-2,5-dione
CID 150503257
(5E,7S)-7-(hydroxymethyl)-1-methyl-3,4,7,8-tetrahydro-2H-azonin-9-one
CID 10976141
2-cyclopent-2-en-1-yl-N-(2-hydroxyethyl)-N-methylacetamide
CID 60681925
2-cyclopent-2-en-1-yl-N-ethyl-N-(2-hydroxyethyl)acetamide
CID 60682120
2-cyclopent-2-en-1-yl-N-(2-hydroxyethyl)-N-propylacetamide
CID 60682128
N-(3-hydroxypropyl)-N-propan-2-ylcyclohex-3-ene-1-carboxamide
CID 61040047
2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)-N-propan-2-ylacetamide
CID 61040291

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide?
The IUPAC name of N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide (CID 115771738) is N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide.
What is the SMILES notation for N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide?
The canonical SMILES for N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide is CCN(CCCO)C(=O)C1CC=CC1.
What is the InChIKey of N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide?
The InChIKey is JRBLFTAGVHILSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-2-12(8-5-9-13)11(14)10-6-3-4-7-10/h3-4,10,13H,2,5-9H2,1H3.
What are the key properties of N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide?
N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide has a molecular weight of 197.28 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-hydroxypropyl)cyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 115771738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).