N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide

C18H24N2O2 — CID 18578048

IUPACN-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide
SMILESCC(=O)N1CCCc2ccc(NC(=O)C3CCCCC3)cc21
InChIInChI=1S/C18H24N2O2/c1-13(21)20-11-5-8-14-9-10-16(12-17(14)20)19-18(22)15-6-3-2-4-7-15/h9-10,12,15H,2-8,11H2,1H3,(H,19,22)
InChIKeyAEPQTMYBPXTKMP-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.50
Rot. Bonds2

About N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide

N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide (PubChem CID 18578048) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide
PubChem CID18578048
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide
SMILESCC(=O)N1CCCc2ccc(NC(=O)C3CCCCC3)cc21
InChIInChI=1S/C18H24N2O2/c1-13(21)20-11-5-8-14-9-10-16(12-17(14)20)19-18(22)15-6-3-2-4-7-15/h9-10,12,15H,2-8,11H2,1H3,(H,19,22)
InChIKeyAEPQTMYBPXTKMP-UHFFFAOYSA-N
XLogP3.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide?
The IUPAC name of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide (CID 18578048) is N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide.
What is the SMILES notation for N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide?
The canonical SMILES for N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide is CC(=O)N1CCCc2ccc(NC(=O)C3CCCCC3)cc21.
What is the InChIKey of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide?
The InChIKey is AEPQTMYBPXTKMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-13(21)20-11-5-8-14-9-10-16(12-17(14)20)19-18(22)15-6-3-2-4-7-15/h9-10,12,15H,2-8,11H2,1H3,(H,19,22).
What are the key properties of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide?
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide has a molecular weight of 300.40 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)cyclohexanecarboxamide is sourced from PubChem (CID 18578048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).