N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide

C20H18FN3O2 — CID 113026998

IUPACN-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(NCc2ccccc2F)cn1
InChIInChI=1S/C20H18FN3O2/c1-26-18-9-5-3-7-16(18)20(25)24-19-11-10-15(13-23-19)22-12-14-6-2-4-8-17(14)21/h2-11,13,22H,12H2,1H3,(H,23,24,25)
InChIKeyGHXYEWPDLCUKPN-UHFFFAOYSA-N
MW351.38 g/mol
LogP4.09
Rot. Bonds6

About N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide

N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide (PubChem CID 113026998) has the molecular formula C20H18FN3O2 and a molecular weight of 351.38 g/mol. Its IUPAC name is N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide
PubChem CID113026998
Molecular FormulaC20H18FN3O2
Molecular Weight351.38 g/mol
Exact Mass351.14
IUPAC NameN-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(NCc2ccccc2F)cn1
InChIInChI=1S/C20H18FN3O2/c1-26-18-9-5-3-7-16(18)20(25)24-19-11-10-15(13-23-19)22-12-14-6-2-4-8-17(14)21/h2-11,13,22H,12H2,1H3,(H,23,24,25)
InChIKeyGHXYEWPDLCUKPN-UHFFFAOYSA-N
XLogP4.09
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.38
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]benzamide
CID 113026995
N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-2,6-dimethoxybenzamide
CID 113028188
N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113027011
3,4-difluoro-N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]benzamide
CID 113027357
2-(4-fluorophenyl)-N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]acetamide
CID 113027342
N-[4-[2-(2-fluorophenyl)ethylamino]phenyl]-2-methoxybenzamide
CID 112983392
2-(4-chlorophenyl)-N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]acetamide
CID 113027010
N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-3,4-dimethoxybenzamide
CID 113028190
N-[4-[(2-fluorophenyl)methylamino]phenyl]-2,6-dimethoxybenzamide
CID 112982382
5-[(2-fluorophenyl)methylamino]-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109189465
N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]thiophene-2-carboxamide
CID 113026990
N-[(2-fluorophenyl)methyl]-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109189345

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide?
The IUPAC name of N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide (CID 113026998) is N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide.
What is the SMILES notation for N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide?
The canonical SMILES for N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(NCc2ccccc2F)cn1.
What is the InChIKey of N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide?
The InChIKey is GHXYEWPDLCUKPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O2/c1-26-18-9-5-3-7-16(18)20(25)24-19-11-10-15(13-23-19)22-12-14-6-2-4-8-17(14)21/h2-11,13,22H,12H2,1H3,(H,23,24,25).
What are the key properties of N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide?
N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide has a molecular weight of 351.38 g/mol, XLogP of 4.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 113026998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).