N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide

C15H15FN2O — CID 134057045

IUPACN-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)Cc2ccccc2F)cn1
InChIInChI=1S/C15H15FN2O/c1-11-7-8-12(9-17-11)15(19)18(2)10-13-5-3-4-6-14(13)16/h3-9H,10H2,1-2H3
InChIKeyQHZMZZWTBSEPKO-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.80
Rot. Bonds3

About N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide

N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide (PubChem CID 134057045) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
PubChem CID134057045
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC NameN-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)Cc2ccccc2F)cn1
InChIInChI=1S/C15H15FN2O/c1-11-7-8-12(9-17-11)15(19)18(2)10-13-5-3-4-6-14(13)16/h3-9H,10H2,1-2H3
InChIKeyQHZMZZWTBSEPKO-UHFFFAOYSA-N
XLogP2.80
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 60628244
5,6-dichloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60628265
3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 78769060
4-carbamothioyl-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 55729757
3-bromo-4-fluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 103706385
2-chloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-4-carboxamide
CID 60692943
6-chloro-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 60631168
N-[(2-fluorophenyl)methyl]-3,4,5-trimethoxy-N-methylbenzamide
CID 4780408
N-[(2-fluorophenyl)methyl]-N-methyl-2-(4-methylbenzoyl)benzamide
CID 36816287
3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 104741078
(2-fluorophenyl)methyl-methylcarbamic acid
CID 115171049
2-bromo-6-fluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 115678174

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide (CID 134057045) is N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide is Cc1ccc(C(=O)N(C)Cc2ccccc2F)cn1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide?
The InChIKey is QHZMZZWTBSEPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O/c1-11-7-8-12(9-17-11)15(19)18(2)10-13-5-3-4-6-14(13)16/h3-9H,10H2,1-2H3.
What are the key properties of N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide?
N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide has a molecular weight of 258.30 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 134057045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).