N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide

C15H22N2O — CID 102778923

IUPACN-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide
SMILESCCN(C(=O)C1NCCC1C)c1cccc(C)c1
InChIInChI=1S/C15H22N2O/c1-4-17(13-7-5-6-11(2)10-13)15(18)14-12(3)8-9-16-14/h5-7,10,12,14,16H,4,8-9H2,1-3H3
InChIKeyHQICYIYQEIQWLW-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.35
Rot. Bonds3

About N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide

N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide (PubChem CID 102778923) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide
PubChem CID102778923
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide
SMILESCCN(C(=O)C1NCCC1C)c1cccc(C)c1
InChIInChI=1S/C15H22N2O/c1-4-17(13-7-5-6-11(2)10-13)15(18)14-12(3)8-9-16-14/h5-7,10,12,14,16H,4,8-9H2,1-3H3
InChIKeyHQICYIYQEIQWLW-UHFFFAOYSA-N
XLogP2.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
3-[ethyl-(3-methylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
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N-(3,5-dimethylphenyl)-N,3-dimethylpyrrolidine-2-carboxamide
CID 102779294
N-ethyl-N-(3-methylphenyl)-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxamide
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N-ethyl-N-(3-methylphenyl)thiane-3-carboxamide
CID 110865038
3-amino-N-ethyl-N-(3-methylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119705842
N-ethyl-N-(3-methylphenyl)-3-piperidin-4-ylpropanamide
CID 62212377
N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide
CID 62212541
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605
N-ethyl-2-methyl-N-phenylpiperidine-4-carboxamide
CID 106738635
N,4-diethyl-N-(3-methylphenyl)piperidine-4-carboxamide
CID 63128862
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CID 109144641

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide (CID 102778923) is N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide is CCN(C(=O)C1NCCC1C)c1cccc(C)c1.
What is the InChIKey of N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide?
The InChIKey is HQICYIYQEIQWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-4-17(13-7-5-6-11(2)10-13)15(18)14-12(3)8-9-16-14/h5-7,10,12,14,16H,4,8-9H2,1-3H3.
What are the key properties of N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide?
N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-N-(3-methylphenyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 102778923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).