1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide

C19H24N4O2 — CID 127245773

IUPAC1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESCOc1ccc(CN2CCCC2(C(=O)N(C)C)c2cnccn2)cc1
InChIInChI=1S/C19H24N4O2/c1-22(2)18(24)19(17-13-20-10-11-21-17)9-4-12-23(19)14-15-5-7-16(25-3)8-6-15/h5-8,10-11,13H,4,9,12,14H2,1-3H3
InChIKeyZFPQQMORLXQGCH-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.06
Rot. Bonds5

About 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide

1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide (PubChem CID 127245773) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide
PubChem CID127245773
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide
SMILESCOc1ccc(CN2CCCC2(C(=O)N(C)C)c2cnccn2)cc1
InChIInChI=1S/C19H24N4O2/c1-22(2)18(24)19(17-13-20-10-11-21-17)9-4-12-23(19)14-15-5-7-16(25-3)8-6-15/h5-8,10-11,13H,4,9,12,14H2,1-3H3
InChIKeyZFPQQMORLXQGCH-UHFFFAOYSA-N
XLogP2.06
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N,N-dimethyl-1-[(6-methyl-3-pyridinyl)methyl]-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 124991235
(2S)-N,N-dimethyl-2-pyrazin-2-yl-1-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 124986361
(1-benzyl-2-pyrazin-2-ylpyrrolidin-2-yl)-pyrrolidin-1-ylmethanone
CID 127245882
(2R)-N-methyl-1-[(1-methylpyrazol-4-yl)methyl]-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 125005876
(2S)-N,N-dimethyl-1-(2-piperidin-1-ylacetyl)-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 124963497
(2R)-1-[(3-chlorophenyl)methyl]-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 125011653
1-[(2,4-dimethylphenyl)methyl]-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 118740294
(2R)-N,N-dimethyl-2-pyrazin-2-yl-1-(1,3-thiazole-4-carbonyl)pyrrolidine-2-carboxamide
CID 125006234
(2S)-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 125012324
(2R)-N,N-dimethyl-1-[(2-phenylmethoxyphenyl)methyl]-2-pyridin-2-ylpyrrolidine-2-carboxamide
CID 129458042
[(3S)-3-hydroxy-3-[[(4-methoxyphenyl)methyl-methylamino]methyl]pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 124947723
(2S)-1-[(2-chlorophenyl)methyl]-2-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 124944335

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide (CID 127245773) is 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide is COc1ccc(CN2CCCC2(C(=O)N(C)C)c2cnccn2)cc1.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
The InChIKey is ZFPQQMORLXQGCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22(2)18(24)19(17-13-20-10-11-21-17)9-4-12-23(19)14-15-5-7-16(25-3)8-6-15/h5-8,10-11,13H,4,9,12,14H2,1-3H3.
What are the key properties of 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide?
1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]-N,N-dimethyl-2-pyrazin-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 127245773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).