N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide

C20H18FN3O2 — CID 109211205

IUPACN-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(Nc2ccnc(C(=O)NCc3ccccc3F)c2)cc1
InChIInChI=1S/C20H18FN3O2/c1-26-17-8-6-15(7-9-17)24-16-10-11-22-19(12-16)20(25)23-13-14-4-2-3-5-18(14)21/h2-12H,13H2,1H3,(H,22,24)(H,23,25)
InChIKeyIZPGWOKFTOUUGP-UHFFFAOYSA-N
MW351.38 g/mol
LogP3.90
Rot. Bonds6

About N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide

N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide (PubChem CID 109211205) has the molecular formula C20H18FN3O2 and a molecular weight of 351.38 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide
PubChem CID109211205
Molecular FormulaC20H18FN3O2
Molecular Weight351.38 g/mol
Exact Mass351.14
IUPAC NameN-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(Nc2ccnc(C(=O)NCc3ccccc3F)c2)cc1
InChIInChI=1S/C20H18FN3O2/c1-26-17-8-6-15(7-9-17)24-16-10-11-22-19(12-16)20(25)23-13-14-4-2-3-5-18(14)21/h2-12H,13H2,1H3,(H,22,24)(H,23,25)
InChIKeyIZPGWOKFTOUUGP-UHFFFAOYSA-N
XLogP3.90
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 ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-ethoxyanilino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109211207
4-(4-cyanoanilino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109211244
4-(4-methoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214302
N-(2-fluorophenyl)-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109220605
4-(3-methoxyanilino)-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109212009
N-[(2-fluorophenyl)methyl]-4-hydrazinylpyridine-2-carboxamide
CID 62247959
4-(4-ethylanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109213974
4-(3-fluoroanilino)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109212227
4-(4-acetamidoanilino)-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109212022
4-(3,4-difluoroanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109214014
2-(3,4-dimethoxyanilino)-N-[(2-fluorophenyl)methyl]pyrimidine-4-carboxamide
CID 109305458
4-(4-acetylanilino)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109212220

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide (CID 109211205) is N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide is COc1ccc(Nc2ccnc(C(=O)NCc3ccccc3F)c2)cc1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide?
The InChIKey is IZPGWOKFTOUUGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O2/c1-26-17-8-6-15(7-9-17)24-16-10-11-22-19(12-16)20(25)23-13-14-4-2-3-5-18(14)21/h2-12H,13H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide?
N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide has a molecular weight of 351.38 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-4-(4-methoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109211205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).