2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide

C10H18N2O — CID 83079812

IUPAC2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide
SMILESC=CCNC(=O)C1(CC)CCCN1
InChIInChI=1S/C10H18N2O/c1-3-7-11-9(13)10(4-2)6-5-8-12-10/h3,12H,1,4-8H2,2H3,(H,11,13)
InChIKeyCSNPEGCOBSZEHQ-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.82
Rot. Bonds4

About 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide

2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide (PubChem CID 83079812) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide
PubChem CID83079812
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide
SMILESC=CCNC(=O)C1(CC)CCCN1
InChIInChI=1S/C10H18N2O/c1-3-7-11-9(13)10(4-2)6-5-8-12-10/h3,12H,1,4-8H2,2H3,(H,11,13)
InChIKeyCSNPEGCOBSZEHQ-UHFFFAOYSA-N
XLogP0.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.82
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

1-(2-ethylpyrrolidin-2-yl)prop-2-en-1-one
CID 116608144
3-[(2-ethylpyrrolidine-2-carbonyl)amino]-2-methylpropanoic acid
CID 83071374
2-ethyl-N-[3-(methylamino)-3-oxopropyl]pyrrolidine-2-carboxamide
CID 83071991
N-(2,3-dihydroxypropyl)-2-ethylpyrrolidine-2-carboxamide
CID 83072487
2-ethyl-N-[(3-methyloxetan-3-yl)methyl]pyrrolidine-2-carboxamide
CID 83073298
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-ethylpyrrolidine-2-carboxamide
CID 114009242
2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide
CID 103307069
N-(azetidin-3-yl)-2-ethylpyrrolidine-2-carboxamide;hydrochloride
CID 130637882
N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylpyrrolidine-2-carboxamide
CID 83071544
3-[(2-ethylpyrrolidine-2-carbonyl)amino]-2-methoxypropanoic acid
CID 106108847
N-[2-(dimethylsulfamoyl)ethyl]-2-ethylpyrrolidine-2-carboxamide
CID 106337546
N-[4-(cyclopropylamino)-4-oxobutyl]-2-ethylpyrrolidine-2-carboxamide
CID 83073445

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide (CID 83079812) is 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide is C=CCNC(=O)C1(CC)CCCN1.
What is the InChIKey of 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide?
The InChIKey is CSNPEGCOBSZEHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-7-11-9(13)10(4-2)6-5-8-12-10/h3,12H,1,4-8H2,2H3,(H,11,13).
What are the key properties of 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide?
2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide is sourced from PubChem (CID 83079812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).