N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide

C24H19N3O3 — CID 55903332

IUPACN-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1cccc(CNC(=O)c2cc3ccccc3cc2O)c1)c1ccncc1
InChIInChI=1S/C24H19N3O3/c28-22-14-19-6-2-1-5-18(19)13-21(22)24(30)26-15-16-4-3-7-20(12-16)27-23(29)17-8-10-25-11-9-17/h1-14,28H,15H2,(H,26,30)(H,27,29)
InChIKeyTZDZCALZCQZSHC-UHFFFAOYSA-N
MW397.43 g/mol
LogP4.12
Rot. Bonds5

About N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide

N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide (PubChem CID 55903332) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide
PubChem CID55903332
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC NameN-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1cccc(CNC(=O)c2cc3ccccc3cc2O)c1)c1ccncc1
InChIInChI=1S/C24H19N3O3/c28-22-14-19-6-2-1-5-18(19)13-21(22)24(30)26-15-16-4-3-7-20(12-16)27-23(29)17-8-10-25-11-9-17/h1-14,28H,15H2,(H,26,30)(H,27,29)
InChIKeyTZDZCALZCQZSHC-UHFFFAOYSA-N
XLogP4.12
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 54.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(benzamidomethyl)phenyl]pyridine-4-carboxamide
CID 166187411
N-[3-[[(2-ethoxybenzoyl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 47064652
N-[3-[[3-(2-hydroxyphenyl)propanoylamino]methyl]phenyl]pyridine-4-carboxamide
CID 47064659
N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926411
N-[3-(naphthalene-1-carbonylamino)phenyl]pyridine-4-carboxamide
CID 55610557
3-hydroxy-N-[(3-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 27231686
N-[3-[[[2-(4-chlorophenyl)acetyl]amino]methyl]phenyl]pyridine-4-carboxamide
CID 47064649
N-[3-[[(5-methylthiophene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 55904354
N-[(3-hydroxyphenyl)methyl]pyridine-4-carboxamide
CID 47292120
N-[3-[[(5-nitrofuran-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 60540832
N-[3-[[(4-bromo-3,5-dimethoxybenzoyl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 55903083
ethyl [4-[[3-[[(2-hydroxybenzoyl)amino]methyl]phenyl]carbamoyl]phenyl] carbonate
CID 108931936

Frequently Asked Questions

What is the IUPAC name of N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide?
The IUPAC name of N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide (CID 55903332) is N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide is O=C(Nc1cccc(CNC(=O)c2cc3ccccc3cc2O)c1)c1ccncc1.
What is the InChIKey of N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide?
The InChIKey is TZDZCALZCQZSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c28-22-14-19-6-2-1-5-18(19)13-21(22)24(30)26-15-16-4-3-7-20(12-16)27-23(29)17-8-10-25-11-9-17/h1-14,28H,15H2,(H,26,30)(H,27,29).
What are the key properties of N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide?
N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide has a molecular weight of 397.43 g/mol, XLogP of 4.12, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[(3-hydroxynaphthalene-2-carbonyl)amino]methyl]phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 55903332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).