N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide

C17H24N2O — CID 47358375

IUPACN-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)NC1CCCC1
InChIInChI=1S/C17H24N2O/c20-17(18-15-8-2-3-9-15)11-13-19-12-5-7-14-6-1-4-10-16(14)19/h1,4,6,10,15H,2-3,5,7-9,11-13H2,(H,18,20)
InChIKeyKQRIXGFCTRCLAY-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.89
Rot. Bonds4

About N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide

N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide (PubChem CID 47358375) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
PubChem CID47358375
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)NC1CCCC1
InChIInChI=1S/C17H24N2O/c20-17(18-15-8-2-3-9-15)11-13-19-12-5-7-14-6-1-4-10-16(14)19/h1,4,6,10,15H,2-3,5,7-9,11-13H2,(H,18,20)
InChIKeyKQRIXGFCTRCLAY-UHFFFAOYSA-N
XLogP2.89
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
The IUPAC name of N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide (CID 47358375) is N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
The canonical SMILES for N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide is O=C(CCN1CCCc2ccccc21)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
The InChIKey is KQRIXGFCTRCLAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c20-17(18-15-8-2-3-9-15)11-13-19-12-5-7-14-6-1-4-10-16(14)19/h1,4,6,10,15H,2-3,5,7-9,11-13H2,(H,18,20).
What are the key properties of N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide has a molecular weight of 272.39 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide is sourced from PubChem (CID 47358375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).