N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide

C15H16FN3O — CID 62239255

IUPACN-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)N(C)Cc2cccc(F)c2)n1
InChIInChI=1S/C15H16FN3O/c1-17-14-8-4-7-13(18-14)15(20)19(2)10-11-5-3-6-12(16)9-11/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyRHMSHHHHEYPNQP-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.53
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide

N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide (PubChem CID 62239255) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
PubChem CID62239255
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC NameN-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)N(C)Cc2cccc(F)c2)n1
InChIInChI=1S/C15H16FN3O/c1-17-14-8-4-7-13(18-14)15(20)19(2)10-11-5-3-6-12(16)9-11/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyRHMSHHHHEYPNQP-UHFFFAOYSA-N
XLogP2.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-fluorophenyl)methyl]-6-hydrazinyl-N-methylpyridine-2-carboxamide
CID 62238406
6-chloro-N-[(3-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 62235425
N-methyl-6-(methylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 62239472
N-[(3-fluorophenyl)methyl]-N-methyl-2-(methylamino)benzamide
CID 61376480
6-chloro-N-[(3-fluorophenyl)methyl]-N-methylpyridazine-3-carboxamide
CID 60857881
N-[(3-fluorophenyl)methyl]-N-methyl-2-(methylamino)pyridine-3-carboxamide
CID 62170886
N-[(3-fluorophenyl)methyl]-N-methylbenzamide
CID 60631048
N-[(3-fluorophenyl)methyl]-N-methyl-5-(2-methylpropyl)-1H-pyrazole-3-carboxamide
CID 78880562
N-[(3-fluorophenyl)methyl]-N-methylnaphthalene-1-carboxamide
CID 18113904
1-(3-fluorophenyl)-N-[(3-fluorophenyl)methyl]-N-methylpyrazole-3-carboxamide
CID 86844397
N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 63725681
N-[(3-fluorophenyl)methyl]-3,5-dihydroxy-N-methylbenzamide
CID 103891567

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide (CID 62239255) is N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide is CNc1cccc(C(=O)N(C)Cc2cccc(F)c2)n1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is RHMSHHHHEYPNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c1-17-14-8-4-7-13(18-14)15(20)19(2)10-11-5-3-6-12(16)9-11/h3-9H,10H2,1-2H3,(H,17,18).
What are the key properties of N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 273.31 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62239255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).