3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide

C14H14FN3O — CID 62649935

IUPAC3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide
SMILESCNc1c(F)cccc1C(=O)NCc1ccccn1
InChIInChI=1S/C14H14FN3O/c1-16-13-11(6-4-7-12(13)15)14(19)18-9-10-5-2-3-8-17-10/h2-8,16H,9H2,1H3,(H,18,19)
InChIKeyPZRBKFUYNQZINI-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.19
Rot. Bonds4

About 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide

3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 62649935) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide
PubChem CID62649935
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide
SMILESCNc1c(F)cccc1C(=O)NCc1ccccn1
InChIInChI=1S/C14H14FN3O/c1-16-13-11(6-4-7-12(13)15)14(19)18-9-10-5-2-3-8-17-10/h2-8,16H,9H2,1H3,(H,18,19)
InChIKeyPZRBKFUYNQZINI-UHFFFAOYSA-N
XLogP2.19
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-2-(methylamino)-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62662132
N-benzyl-3-fluoro-2-(methylamino)benzamide
CID 55100092
3-fluoro-2-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide
CID 62660002
N-[(2-ethylphenyl)methyl]-3-fluoro-2-(methylamino)benzamide
CID 64693951
2-fluoro-N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]benzamide
CID 4781382
3-(methylamino)-2-nitro-N-(pyridin-2-ylmethyl)benzamide
CID 115548346
2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide
CID 9414595
3-fluoro-2-(methylamino)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 63824200
2-amino-3-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 16787973
2-bromo-3-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 113338677
3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
CID 62648542
2,3-dichloro-N-(pyridin-2-ylmethyl)benzamide
CID 1247422

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide (CID 62649935) is 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide is CNc1c(F)cccc1C(=O)NCc1ccccn1.
What is the InChIKey of 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is PZRBKFUYNQZINI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-16-13-11(6-4-7-12(13)15)14(19)18-9-10-5-2-3-8-17-10/h2-8,16H,9H2,1H3,(H,18,19).
What are the key properties of 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide?
3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 259.28 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 62649935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).