N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide

C23H23N3O3 — CID 51362775

IUPACN-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide
SMILESO=C(CCCC(=O)Nc1cccnc1)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H23N3O3/c27-22(9-4-10-23(28)26-20-8-5-15-24-16-20)25-19-11-13-21(14-12-19)29-17-18-6-2-1-3-7-18/h1-3,5-8,11-16H,4,9-10,17H2,(H,25,27)(H,26,28)
InChIKeyYIUMCQYNZPDBOC-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.41
Rot. Bonds9

About N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide

N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide (PubChem CID 51362775) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide.

Molecular Properties

Compound NameN-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide
PubChem CID51362775
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC NameN-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide
SMILESO=C(CCCC(=O)Nc1cccnc1)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H23N3O3/c27-22(9-4-10-23(28)26-20-8-5-15-24-16-20)25-19-11-13-21(14-12-19)29-17-18-6-2-1-3-7-18/h1-3,5-8,11-16H,4,9-10,17H2,(H,25,27)(H,26,28)
InChIKeyYIUMCQYNZPDBOC-UHFFFAOYSA-N
XLogP4.41
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide 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-oxo-4-(4-phenylmethoxyanilino)butyl]azanium
CID 42149432
1-(4-phenylmethoxyphenyl)-3-(pyridin-3-ylmethyl)urea
CID 110706294
N-[4-(4-phenylmethoxyanilino)phenyl]pyridine-3-carboxamide
CID 112988913
N-(2-anilino-2-oxoethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 166190877
3-(2-hydroxyethylamino)-N-(4-phenylmethoxyphenyl)propanamide
CID 143395384
5-(carbamoylamino)-N-(4-phenylmethoxyphenyl)pentanamide
CID 9034708
3-phenoxy-N-[4-(pyridin-3-ylmethylamino)phenyl]propanamide
CID 112983036
N-[(4-phenylmethoxyphenyl)carbamothioyl]pyridine-3-carboxamide
CID 1297746
3,3-dimethyl-5-oxo-N-(4-phenylmethoxyphenyl)-5-[2-(pyridine-3-carbonyl)hydrazinyl]pentanamide
CID 3888053
N-naphthalen-2-yl-2-[4-(pyridin-3-ylmethoxy)phenoxy]acetamide
CID 71939692
methyl (2S)-2-[[5-oxo-5-(4-phenylmethoxyanilino)pentanoyl]amino]-3-phenylpropanoate
CID 41263642
4-chloro-N-(3-phenylmethoxyphenyl)butanamide
CID 17161005

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide?
The IUPAC name of N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide (CID 51362775) is N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide.
What is the SMILES notation for N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide?
The canonical SMILES for N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide is O=C(CCCC(=O)Nc1cccnc1)Nc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide?
The InChIKey is YIUMCQYNZPDBOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c27-22(9-4-10-23(28)26-20-8-5-15-24-16-20)25-19-11-13-21(14-12-19)29-17-18-6-2-1-3-7-18/h1-3,5-8,11-16H,4,9-10,17H2,(H,25,27)(H,26,28).
What are the key properties of N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide?
N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide has a molecular weight of 389.46 g/mol, XLogP of 4.41, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide is sourced from PubChem (CID 51362775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).