N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide

C24H23N3O — CID 126259376

IUPACN-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide
SMILESCCn1c(C)c(/C=N\NC(=O)Cc2cccc3ccccc23)c2ccccc21
InChIInChI=1S/C24H23N3O/c1-3-27-17(2)22(21-13-6-7-14-23(21)27)16-25-26-24(28)15-19-11-8-10-18-9-4-5-12-20(18)19/h4-14,16H,3,15H2,1-2H3,(H,26,28)/b25-16-
InChIKeyWKQLKPUYXVDUNV-XYGWBWBKSA-N
MW369.47 g/mol
LogP4.82
Rot. Bonds5

About N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide

N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide (PubChem CID 126259376) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide
PubChem CID126259376
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC NameN-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide
SMILESCCn1c(C)c(/C=N\NC(=O)Cc2cccc3ccccc23)c2ccccc21
InChIInChI=1S/C24H23N3O/c1-3-27-17(2)22(21-13-6-7-14-23(21)27)16-25-26-24(28)15-19-11-8-10-18-9-4-5-12-20(18)19/h4-14,16H,3,15H2,1-2H3,(H,26,28)/b25-16-
InChIKeyWKQLKPUYXVDUNV-XYGWBWBKSA-N
XLogP4.82
TPSA46.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 54.82
H-Bond Donors ≤ 51
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'}

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Related Compounds

N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
CID 110526283
[(1-ethyl-2-methylindol-3-yl)methylideneamino]thiourea
CID 3642739
2-amino-N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]benzamide
CID 110512126
2-bromo-N-[(E)-(1-ethyl-2-methylindol-3-yl)methylideneamino]benzamide
CID 17245319
1-[(E)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-3-phenylthiourea
CID 110508605
N-[(E)-(1-benzyl-2-methylindol-3-yl)methylideneamino]-2-(4-fluorophenyl)acetamide
CID 126258425
N-[(E)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylideneamino]-2-naphthalen-1-ylacetamide
CID 135536611
2-(4-methoxyphenyl)-N-[(E)-(2-methyl-1-prop-2-enylindol-3-yl)methylideneamino]acetamide
CID 21370835
N-[(Z)-[2-methyl-1-(naphthalen-1-ylmethyl)indol-3-yl]methylideneamino]-4-propoxybenzamide
CID 92659209
ethyl 2-[3-[(Z)-[[2-(2,4-dimethylphenyl)acetyl]hydrazinylidene]methyl]-2-methylindol-1-yl]acetate
CID 99944814
2,4-dichloro-N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]benzamide
CID 126375327
2-(4-chlorophenyl)-N-[(E)-(2-methyl-1-prop-2-enylindol-3-yl)methylideneamino]acetamide
CID 21379856

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide?
The IUPAC name of N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide (CID 126259376) is N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide is CCn1c(C)c(/C=N\NC(=O)Cc2cccc3ccccc23)c2ccccc21.
What is the InChIKey of N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide?
The InChIKey is WKQLKPUYXVDUNV-XYGWBWBKSA-N. The full InChI is InChI=1S/C24H23N3O/c1-3-27-17(2)22(21-13-6-7-14-23(21)27)16-25-26-24(28)15-19-11-8-10-18-9-4-5-12-20(18)19/h4-14,16H,3,15H2,1-2H3,(H,26,28)/b25-16-.
What are the key properties of N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide?
N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide has a molecular weight of 369.47 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(1-ethyl-2-methylindol-3-yl)methylideneamino]-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 126259376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).