2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide

C20H23FN2O — CID 155984850

IUPAC2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1(Cc2ccccc2-c2ccccc2F)CCCN1
InChIInChI=1S/C20H23FN2O/c1-23(2)19(24)20(12-7-13-22-20)14-15-8-3-4-9-16(15)17-10-5-6-11-18(17)21/h3-6,8-11,22H,7,12-14H2,1-2H3
InChIKeyAJYZJFCAGSVCHC-UHFFFAOYSA-N
MW326.42 g/mol
LogP3.25
Rot. Bonds4

About 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide

2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide (PubChem CID 155984850) has the molecular formula C20H23FN2O and a molecular weight of 326.42 g/mol. Its IUPAC name is 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide
PubChem CID155984850
Molecular FormulaC20H23FN2O
Molecular Weight326.42 g/mol
Exact Mass326.18
IUPAC Name2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1(Cc2ccccc2-c2ccccc2F)CCCN1
InChIInChI=1S/C20H23FN2O/c1-23(2)19(24)20(12-7-13-22-20)14-15-8-3-4-9-16(15)17-10-5-6-11-18(17)21/h3-6,8-11,22H,7,12-14H2,1-2H3
InChIKeyAJYZJFCAGSVCHC-UHFFFAOYSA-N
XLogP3.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 53398104
(2R)-2-[(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 2761825
2-[(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 53398103
1-butanoyl-3-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-3-carboxamide
CID 110230993
3-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethyl-1-(3-methylbutanoyl)pyrrolidine-3-carboxamide
CID 110230994
(3S)-3-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethyl-1-[(2S)-spiro[2.3]hexane-2-carbonyl]pyrrolidine-3-carboxamide
CID 92605155
2-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acid;hydrochloride
CID 53398043
2-[(2-bromophenyl)methyl]piperidine-2-carboxylic acid
CID 115103755
(2R)-N,N-dimethyl-2-(3-pyridin-3-ylpropyl)pyrrolidine-2-carboxamide
CID 95804757
(3S)-1-(3-fluorobenzoyl)-3-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-3-carboxamide
CID 92605392
(2R)-2-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 2761894
(2R)-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 2761904

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide (CID 155984850) is 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide is CN(C)C(=O)C1(Cc2ccccc2-c2ccccc2F)CCCN1.
What is the InChIKey of 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide?
The InChIKey is AJYZJFCAGSVCHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O/c1-23(2)19(24)20(12-7-13-22-20)14-15-8-3-4-9-16(15)17-10-5-6-11-18(17)21/h3-6,8-11,22H,7,12-14H2,1-2H3.
What are the key properties of 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide?
2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide has a molecular weight of 326.42 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-fluorophenyl)phenyl]methyl]-N,N-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 155984850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).