(2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide

C22H23N3O — CID 5390539

IUPAC(2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide
SMILESC/C(=N/NC(=O)[C@@H](C)Nc1ccc2ccccc2c1)c1ccc(C)cc1
InChIInChI=1S/C22H23N3O/c1-15-8-10-18(11-9-15)16(2)24-25-22(26)17(3)23-21-13-12-19-6-4-5-7-20(19)14-21/h4-14,17,23H,1-3H3,(H,25,26)/b24-16-/t17-/m1/s1
InChIKeyCWXRPAKIQZWFRM-GIKSKMNSSA-N
MW345.45 g/mol
LogP4.49
Rot. Bonds5

About (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide

(2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide (PubChem CID 5390539) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide
PubChem CID5390539
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name(2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide
SMILESC/C(=N/NC(=O)[C@@H](C)Nc1ccc2ccccc2c1)c1ccc(C)cc1
InChIInChI=1S/C22H23N3O/c1-15-8-10-18(11-9-15)16(2)24-25-22(26)17(3)23-21-13-12-19-6-4-5-7-20(19)14-21/h4-14,17,23H,1-3H3,(H,25,26)/b24-16-/t17-/m1/s1
InChIKeyCWXRPAKIQZWFRM-GIKSKMNSSA-N
XLogP4.49
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide 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

(2S)-2-(naphthalen-2-ylamino)-N-[(Z)-1-phenylethylideneamino]propanamide
CID 6858361
(2R)-2-(4-iodo-3-methylanilino)-N-[(E)-1-naphthalen-2-ylethylideneamino]propanamide
CID 28872870
2-(4-methoxyanilino)-N-(1-naphthalen-2-ylethylideneamino)propanamide
CID 71960241
2-(3-chloroanilino)-N-[1-(4-methylphenyl)ethylideneamino]propanamide
CID 4654925
(2S)-2-(2,4-dimethylanilino)-N-(1-naphthalen-2-ylethylideneamino)propanamide
CID 999697
(2S)-N-[(Z)-(4-methylphenyl)methylideneamino]-2-(naphthalen-2-ylamino)propanamide
CID 5390587
2-(4-ethoxyanilino)-N-(1-naphthalen-2-ylethylideneamino)propanamide
CID 71960214
(2R)-2-(4-methoxyanilino)-N-[(E)-1-phenylethylideneamino]propanamide
CID 5403118
(2S)-2-anilino-N-[(Z)-1-(4-fluorophenyl)ethylideneamino]propanamide
CID 51414732
(2S)-N-[(Z)-benzylideneamino]-2-(naphthalen-2-ylamino)propanamide
CID 5390537
2-(4-chloroanilino)-N-[1-(4-methoxyphenyl)ethylideneamino]propanamide
CID 71960114
2-(naphthalen-2-ylamino)-N-(1-phenylbutan-2-ylideneamino)propanamide
CID 4274264

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide?
The IUPAC name of (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide (CID 5390539) is (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide.
What is the SMILES notation for (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide?
The canonical SMILES for (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide is C/C(=N/NC(=O)[C@@H](C)Nc1ccc2ccccc2c1)c1ccc(C)cc1.
What is the InChIKey of (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide?
The InChIKey is CWXRPAKIQZWFRM-GIKSKMNSSA-N. The full InChI is InChI=1S/C22H23N3O/c1-15-8-10-18(11-9-15)16(2)24-25-22(26)17(3)23-21-13-12-19-6-4-5-7-20(19)14-21/h4-14,17,23H,1-3H3,(H,25,26)/b24-16-/t17-/m1/s1.
What are the key properties of (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide?
(2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide has a molecular weight of 345.45 g/mol, XLogP of 4.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(Z)-1-(4-methylphenyl)ethylideneamino]-2-(naphthalen-2-ylamino)propanamide is sourced from PubChem (CID 5390539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).