N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide

C22H23N3O2 — CID 109165135

IUPACN-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)ccn1
InChIInChI=1S/C22H23N3O2/c1-2-13-23-21-15-18(12-14-24-21)22(26)25-19-8-10-20(11-9-19)27-16-17-6-4-3-5-7-17/h3-12,14-15H,2,13,16H2,1H3,(H,23,24)(H,25,26)
InChIKeyJQNLEPFFUGCKKF-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.73
Rot. Bonds8

About N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide

N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 109165135) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID109165135
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)ccn1
InChIInChI=1S/C22H23N3O2/c1-2-13-23-21-15-18(12-14-24-21)22(26)25-19-8-10-20(11-9-19)27-16-17-6-4-3-5-7-17/h3-12,14-15H,2,13,16H2,1H3,(H,23,24)(H,25,26)
InChIKeyJQNLEPFFUGCKKF-UHFFFAOYSA-N
XLogP4.73
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-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

N-butyl-2-(4-phenylmethoxyanilino)pyridine-4-carboxamide
CID 109165508
5-N-(4-phenylmethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101290
N-(4-ethoxyphenyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109172946
N-(3-methylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172134
5-(butylamino)-N-(4-phenylmethoxyphenyl)pyridine-3-carboxamide
CID 109224692
N-(4-ethoxyphenyl)-2-(pyridin-2-ylmethylamino)pyridine-4-carboxamide
CID 109171760
N-(3-phenylpropyl)-2-(propylamino)pyridine-4-carboxamide
CID 109165110
N-(3-fluorophenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62166192
3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 2791610
4-heptoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 4950725
N-(4-ethylphenyl)-2-[2-(2-fluorophenyl)ethylamino]pyridine-4-carboxamide
CID 109172552
4-ethoxy-3-methyl-N-(4-phenylmethoxyphenyl)benzamide
CID 30147613

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide (CID 109165135) is N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)ccn1.
What is the InChIKey of N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is JQNLEPFFUGCKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-2-13-23-21-15-18(12-14-24-21)22(26)25-19-8-10-20(11-9-19)27-16-17-6-4-3-5-7-17/h3-12,14-15H,2,13,16H2,1H3,(H,23,24)(H,25,26).
What are the key properties of N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide?
N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 4.73, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylmethoxyphenyl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109165135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).