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

C18H24N2O2 — CID 50832455

IUPACN-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide
SMILESCC(=O)N1CCCc2ccc(NC(=O)CC3CCCC3)cc21
InChIInChI=1S/C18H24N2O2/c1-13(21)20-10-4-7-15-8-9-16(12-17(15)20)19-18(22)11-14-5-2-3-6-14/h8-9,12,14H,2-7,10-11H2,1H3,(H,19,22)
InChIKeyHFKNYJCGKOILCW-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.50
Rot. Bonds3

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

N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide (PubChem CID 50832455) 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)-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide
PubChem CID50832455
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide
SMILESCC(=O)N1CCCc2ccc(NC(=O)CC3CCCC3)cc21
InChIInChI=1S/C18H24N2O2/c1-13(21)20-10-4-7-15-8-9-16(12-17(15)20)19-18(22)11-14-5-2-3-6-14/h8-9,12,14H,2-7,10-11H2,1H3,(H,19,22)
InChIKeyHFKNYJCGKOILCW-UHFFFAOYSA-N
XLogP3.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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

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Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide?
The IUPAC name of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide (CID 50832455) is N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide.
What is the SMILES notation for N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide?
The canonical SMILES for N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide is CC(=O)N1CCCc2ccc(NC(=O)CC3CCCC3)cc21.
What is the InChIKey of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide?
The InChIKey is HFKNYJCGKOILCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-13(21)20-10-4-7-15-8-9-16(12-17(15)20)19-18(22)11-14-5-2-3-6-14/h8-9,12,14H,2-7,10-11H2,1H3,(H,19,22).
What are the key properties of N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide?
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-cyclopentylacetamide has a molecular weight of 300.40 g/mol, XLogP of 3.50, 3 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)-2-cyclopentylacetamide is sourced from PubChem (CID 50832455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).