3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide

C10H18N2O — CID 127013208

IUPAC3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide
SMILESC=C(C)CNC(=O)N1CCC(C)C1
InChIInChI=1S/C10H18N2O/c1-8(2)6-11-10(13)12-5-4-9(3)7-12/h9H,1,4-7H2,2-3H3,(H,11,13)
InChIKeyYSUFDBQDYZWMTM-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.61
Rot. Bonds2

About 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide

3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide (PubChem CID 127013208) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide
PubChem CID127013208
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide
SMILESC=C(C)CNC(=O)N1CCC(C)C1
InChIInChI=1S/C10H18N2O/c1-8(2)6-11-10(13)12-5-4-9(3)7-12/h9H,1,4-7H2,2-3H3,(H,11,13)
InChIKeyYSUFDBQDYZWMTM-UHFFFAOYSA-N
XLogP1.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.61
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

3-methyl-1-(3-methylpyrrolidin-1-yl)but-3-en-1-one
CID 130627645
(3R)-3-methyl-N-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]pyrrolidine-1-carboxamide
CID 97023650
ethene;1-(3-methylpyrrolidin-1-yl)ethanone
CID 177026606
3-methyl-1-prop-1-en-2-ylpyrrolidine
CID 90249054
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
N-but-3-en-2-yl-3-methylpyrrolidine-1-carboxamide
CID 130703038
4-methyl-N-(2-oxo-2-piperidin-1-ylethyl)piperidine-1-carboxamide
CID 115583845
3-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide
CID 82511399
3-methyl-N-(2,2,4-trimethyl-4-sulfanylpentyl)pyrrolidine-1-carboxamide
CID 155742876
3-methyl-1-[[2-(methylamino)-2-oxoethyl]carbamoyl]piperidine-4-carboxylic acid
CID 114278565
3-methyl-N-prop-2-enylpiperidine-1-carboxamide
CID 108987828
N-[2-(3-methylpyrrolidin-1-yl)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 86937485

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide?
The IUPAC name of 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide (CID 127013208) is 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide is C=C(C)CNC(=O)N1CCC(C)C1.
What is the InChIKey of 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide?
The InChIKey is YSUFDBQDYZWMTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-8(2)6-11-10(13)12-5-4-9(3)7-12/h9H,1,4-7H2,2-3H3,(H,11,13).
What are the key properties of 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide?
3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 127013208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).