N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide

C20H17N3O3 — CID 9033515

IUPACN'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide
SMILESCOc1ccc2cc(/C=C/C(=O)NNC(=O)c3ccccn3)ccc2c1
InChIInChI=1S/C20H17N3O3/c1-26-17-9-8-15-12-14(5-7-16(15)13-17)6-10-19(24)22-23-20(25)18-4-2-3-11-21-18/h2-13H,1H3,(H,22,24)(H,23,25)/b10-6+
InChIKeyWVHNMQXAFPETHW-UXBLZVDNSA-N
MW347.37 g/mol
LogP2.72
Rot. Bonds4

About N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide

N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide (PubChem CID 9033515) has the molecular formula C20H17N3O3 and a molecular weight of 347.37 g/mol. Its IUPAC name is N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound NameN'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide
PubChem CID9033515
Molecular FormulaC20H17N3O3
Molecular Weight347.37 g/mol
Exact Mass347.13
IUPAC NameN'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide
SMILESCOc1ccc2cc(/C=C/C(=O)NNC(=O)c3ccccn3)ccc2c1
InChIInChI=1S/C20H17N3O3/c1-26-17-9-8-15-12-14(5-7-16(15)13-17)6-10-19(24)22-23-20(25)18-4-2-3-11-21-18/h2-13H,1H3,(H,22,24)(H,23,25)/b10-6+
InChIKeyWVHNMQXAFPETHW-UXBLZVDNSA-N
XLogP2.72
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide 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'-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]pyridine-2-carbohydrazide
CID 9332350
N'-[(E)-3-(4-butoxy-3-methoxyphenyl)prop-2-enoyl]pyridine-2-carbohydrazide
CID 9331127
N'-[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoyl]pyridine-2-carbohydrazide
CID 9332990
N-methyl-4-[(E)-3-oxo-3-[2-(pyridine-2-carbonyl)hydrazinyl]prop-1-enyl]benzamide
CID 46556732
(E)-3-(4-methoxyphenyl)-N'-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]prop-2-enehydrazide
CID 21406103
N'-(2,5-dimethoxybenzoyl)pyridine-2-carbohydrazide
CID 8573468
N'-[4-(4-methoxyphenoxy)butanoyl]pyridine-2-carbohydrazide
CID 9332515
(E)-N-(3,5-dimethoxyphenyl)-3-(6-methoxynaphthalen-2-yl)prop-2-enamide
CID 9192243
2-chloro-N'-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]benzohydrazide
CID 35929315
N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 821516
N'-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]pyridine-3-carbohydrazide
CID 26641259
1-[[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea
CID 9325769

Frequently Asked Questions

What is the IUPAC name of N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide?
The IUPAC name of N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide (CID 9033515) is N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide.
What is the SMILES notation for N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide?
The canonical SMILES for N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide is COc1ccc2cc(/C=C/C(=O)NNC(=O)c3ccccn3)ccc2c1.
What is the InChIKey of N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide?
The InChIKey is WVHNMQXAFPETHW-UXBLZVDNSA-N. The full InChI is InChI=1S/C20H17N3O3/c1-26-17-9-8-15-12-14(5-7-16(15)13-17)6-10-19(24)22-23-20(25)18-4-2-3-11-21-18/h2-13H,1H3,(H,22,24)(H,23,25)/b10-6+.
What are the key properties of N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide?
N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide has a molecular weight of 347.37 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 9033515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).