(E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide

C20H18N2O — CID 146177862

IUPAC(E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide
SMILESC/C(=C\c1ccc2ccccc2c1)C(=O)Nc1ccncc1C
InChIInChI=1S/C20H18N2O/c1-14(20(23)22-19-9-10-21-13-15(19)2)11-16-7-8-17-5-3-4-6-18(17)12-16/h3-13H,1-2H3,(H,21,22,23)/b14-11+
InChIKeyYMVDAOHXJGZZPH-SDNWHVSQSA-N
MW302.38 g/mol
LogP4.59
Rot. Bonds3

About (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide

(E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide (PubChem CID 146177862) has the molecular formula C20H18N2O and a molecular weight of 302.38 g/mol. Its IUPAC name is (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide.

Molecular Properties

Compound Name(E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide
PubChem CID146177862
Molecular FormulaC20H18N2O
Molecular Weight302.38 g/mol
Exact Mass302.14
IUPAC Name(E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide
SMILESC/C(=C\c1ccc2ccccc2c1)C(=O)Nc1ccncc1C
InChIInChI=1S/C20H18N2O/c1-14(20(23)22-19-9-10-21-13-15(19)2)11-16-7-8-17-5-3-4-6-18(17)12-16/h3-13H,1-2H3,(H,21,22,23)/b14-11+
InChIKeyYMVDAOHXJGZZPH-SDNWHVSQSA-N
XLogP4.59
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide 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

5-bromo-2-[[(E)-2-methyl-3-naphthalen-2-ylprop-2-enoyl]amino]benzoic acid
CID 146175455
methyl 4,5-dimethoxy-2-[[(E)-2-methyl-3-naphthalen-2-ylprop-2-enoyl]amino]benzoate
CID 22724995
2-[[(Z)-2-bromo-3-naphthalen-2-ylprop-2-enoyl]amino]benzoic acid
CID 146171757
(E)-N-(5-acetyl-2-methylphenyl)-2-methyl-3-phenylprop-2-enamide
CID 110618434
1-methyl-3-(3-methyl-4-pyridinyl)urea
CID 103881209
3-[3-[(3-methyl-4-pyridinyl)carbamoyl]phenyl]prop-2-enoic acid
CID 77004222
2-[[(E)-3-(3,4-dichlorophenyl)-2-methylprop-2-enoyl]amino]benzoic acid
CID 23292237
(Z)-2-methyl-N-[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]-3-phenylprop-2-enamide
CID 153245059
N-(3-methyl-4-pyridinyl)-1H-indole-6-carboxamide
CID 63709047
2-anilino-N-(3-methyl-4-pyridinyl)acetamide
CID 63670867
2-methyl-N-(4-methyl-3-pyridinyl)prop-2-enamide
CID 89097906
2-chloro-N-(3-methyl-4-pyridinyl)acetamide
CID 63669851

Frequently Asked Questions

What is the IUPAC name of (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide?
The IUPAC name of (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide (CID 146177862) is (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide.
What is the SMILES notation for (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide?
The canonical SMILES for (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide is C/C(=C\c1ccc2ccccc2c1)C(=O)Nc1ccncc1C.
What is the InChIKey of (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide?
The InChIKey is YMVDAOHXJGZZPH-SDNWHVSQSA-N. The full InChI is InChI=1S/C20H18N2O/c1-14(20(23)22-19-9-10-21-13-15(19)2)11-16-7-8-17-5-3-4-6-18(17)12-16/h3-13H,1-2H3,(H,21,22,23)/b14-11+.
What are the key properties of (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide?
(E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide has a molecular weight of 302.38 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-N-(3-methyl-4-pyridinyl)-3-naphthalen-2-ylprop-2-enamide is sourced from PubChem (CID 146177862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).