N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide

C24H25N3O3 — CID 4926033

IUPACN-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)NN=Cc2ccc(OC)c3ccccc23)cc1
InChIInChI=1S/C24H25N3O3/c1-3-4-9-23(28)26-19-13-10-17(11-14-19)24(29)27-25-16-18-12-15-22(30-2)21-8-6-5-7-20(18)21/h5-8,10-16H,3-4,9H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyCBCKRVBGVYERHU-UHFFFAOYSA-N
MW403.48 g/mol
LogP4.74
Rot. Bonds8

About N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide

N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide (PubChem CID 4926033) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide.

Molecular Properties

Compound NameN-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide
PubChem CID4926033
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)NN=Cc2ccc(OC)c3ccccc23)cc1
InChIInChI=1S/C24H25N3O3/c1-3-4-9-23(28)26-19-13-10-17(11-14-19)24(29)27-25-16-18-12-15-22(30-2)21-8-6-5-7-20(18)21/h5-8,10-16H,3-4,9H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyCBCKRVBGVYERHU-UHFFFAOYSA-N
XLogP4.74
TPSA79.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide 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-chloro-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
CID 5416523
N-[(2,3-dimethoxyphenyl)methylideneamino]-4-(propanoylamino)benzamide
CID 4981059
N-[(E)-1H-indol-3-ylmethylideneamino]-4-(pentanoylamino)benzamide
CID 135678489
4-(pentanoylamino)-N-[(E)-(2-prop-2-enoxyphenyl)methylideneamino]benzamide
CID 54788777
N-[(4-methoxy-3-methylphenyl)methylideneamino]-4-(pentanoylamino)benzamide
CID 4980442
N-[(4-methoxynaphthalen-1-yl)methylideneamino]pyridine-4-carboxamide
CID 904375
N-(benzylideneamino)-4-(pentanoylamino)benzamide
CID 4926082
N-[(E)-benzylideneamino]-4-(pentanoylamino)benzamide
CID 6232539
N-[(E)-(2-ethoxy-3-methoxyphenyl)methylideneamino]pentanamide
CID 110506839
4-(butanoylamino)-N-[(2-phenylmethoxyphenyl)methylideneamino]benzamide
CID 3372714
N'-[(2-ethoxy-3-methoxyphenyl)methylideneamino]-N-(4-methoxyphenyl)butanediamide
CID 5244595
3-chloro-N-[(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
CID 693396

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide?
The IUPAC name of N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide (CID 4926033) is N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide.
What is the SMILES notation for N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide?
The canonical SMILES for N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide is CCCCC(=O)Nc1ccc(C(=O)NN=Cc2ccc(OC)c3ccccc23)cc1.
What is the InChIKey of N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide?
The InChIKey is CBCKRVBGVYERHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-3-4-9-23(28)26-19-13-10-17(11-14-19)24(29)27-25-16-18-12-15-22(30-2)21-8-6-5-7-20(18)21/h5-8,10-16H,3-4,9H2,1-2H3,(H,26,28)(H,27,29).
What are the key properties of N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide?
N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide has a molecular weight of 403.48 g/mol, XLogP of 4.74, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxynaphthalen-1-yl)methylideneamino]-4-(pentanoylamino)benzamide is sourced from PubChem (CID 4926033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).