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

C10H18N2O — CID 114617185

IUPAC2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide
SMILESC=C(C)CNC(=O)C1CCNC1C
InChIInChI=1S/C10H18N2O/c1-7(2)6-12-10(13)9-4-5-11-8(9)3/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)
InChIKeyQOXKSEORRXEACW-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.68
Rot. Bonds3

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

2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide (PubChem CID 114617185) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide
PubChem CID114617185
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide
SMILESC=C(C)CNC(=O)C1CCNC1C
InChIInChI=1S/C10H18N2O/c1-7(2)6-12-10(13)9-4-5-11-8(9)3/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)
InChIKeyQOXKSEORRXEACW-UHFFFAOYSA-N
XLogP0.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.68
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-[(2-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 79388783
N-[2-(ethylamino)-2-oxoethyl]-2-methylpyrrolidine-3-carboxamide
CID 79388729
N-[2-(tert-butylamino)-2-oxoethyl]-2-methylpyrrolidine-3-carboxamide
CID 79388327
N,2-dimethylpyrrolidine-3-carboxamide
CID 79382983
N-[2-(dimethylamino)ethyl]-2-methylpyrrolidine-3-carboxamide
CID 79383065
N-(2-methylprop-2-enyl)pyrrolidine-2-carboxamide
CID 112703892
2-methylpyrrolidine-3-carbohydrazide
CID 79384311
2-hydroxy-2-methyl-3-[(2-methylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 79385228
2-methyl-N-pent-3-ynylpyrrolidine-3-carboxamide
CID 116644086
2-methyl-N-(3,3,3-trifluoro-2-hydroxypropyl)pyrrolidine-3-carboxamide
CID 102953523
N-[(4-hydroxyphenyl)methyl]-2-methylpyrrolidine-3-carboxamide
CID 114332153
2-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide
CID 79388592

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide?
The IUPAC name of 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide (CID 114617185) is 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide is C=C(C)CNC(=O)C1CCNC1C.
What is the InChIKey of 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide?
The InChIKey is QOXKSEORRXEACW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7(2)6-12-10(13)9-4-5-11-8(9)3/h8-9,11H,1,4-6H2,2-3H3,(H,12,13).
What are the key properties of 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide?
2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 114617185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).