N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide

C15H22N2O2 — CID 102778901

IUPACN-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide
SMILESCOc1ccccc1CN(C)C(=O)C1NCCC1C
InChIInChI=1S/C15H22N2O2/c1-11-8-9-16-14(11)15(18)17(2)10-12-6-4-5-7-13(12)19-3/h4-7,11,14,16H,8-10H2,1-3H3
InChIKeyFEYMQZNLJBKYPN-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.65
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide

N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide (PubChem CID 102778901) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide
PubChem CID102778901
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide
SMILESCOc1ccccc1CN(C)C(=O)C1NCCC1C
InChIInChI=1S/C15H22N2O2/c1-11-8-9-16-14(11)15(18)17(2)10-12-6-4-5-7-13(12)19-3/h4-7,11,14,16H,8-10H2,1-3H3
InChIKeyFEYMQZNLJBKYPN-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide
CID 106739545
(3S)-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 81128624
N-[(2-methoxyphenyl)methyl]-N-methylpiperazine-2-carboxamide
CID 55178802
2-[(2-methoxyphenyl)methyl-methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103977987
N-[(2-methoxyphenyl)methyl]-N,6-dimethylpiperidine-2-carboxamide
CID 61417523
N-[(2,4-dimethylphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide
CID 102778607
N-[(2-methoxyphenyl)methyl]-N-methyl-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119266862
4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide
CID 79511106
(2R,5S)-5-[(2-methoxyphenyl)methyl-methylcarbamoyl]oxolane-2-carboxylic acid
CID 102944496
(2S,4S)-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide
CID 120621349
(2S,4S)-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120621348
2-amino-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 60718962

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide (CID 102778901) is N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide is COc1ccccc1CN(C)C(=O)C1NCCC1C.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide?
The InChIKey is FEYMQZNLJBKYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-8-9-16-14(11)15(18)17(2)10-12-6-4-5-7-13(12)19-3/h4-7,11,14,16H,8-10H2,1-3H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide?
N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 102778901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).