6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one

C17H24N2O — CID 63104828

IUPAC6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCN1C(=O)CCc2cc(C(N)CC3CCCC3)ccc21
InChIInChI=1S/C17H24N2O/c1-19-16-8-6-13(11-14(16)7-9-17(19)20)15(18)10-12-4-2-3-5-12/h6,8,11-12,15H,2-5,7,9-10,18H2,1H3
InChIKeyHQNHROXTJZVRFS-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.18
Rot. Bonds3

About 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one

6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one (PubChem CID 63104828) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one
PubChem CID63104828
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCN1C(=O)CCc2cc(C(N)CC3CCCC3)ccc21
InChIInChI=1S/C17H24N2O/c1-19-16-8-6-13(11-14(16)7-9-17(19)20)15(18)10-12-4-2-3-5-12/h6,8,11-12,15H,2-5,7,9-10,18H2,1H3
InChIKeyHQNHROXTJZVRFS-UHFFFAOYSA-N
XLogP3.18
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one with MolForge

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Related Compounds

6-(1-amino-2-cyclohexylethyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63105199
5-(1-amino-2-cyclohexylethyl)-1-methyl-3H-indol-2-one
CID 43119558
5-(1-amino-2-cyclobutylethyl)-1-methyl-3H-indol-2-one
CID 103162728
6-(2-cyclopentyl-1-hydroxyethyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63104653
6-(1-amino-2-chloroethyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 116937542
6-(1,3-diaminopropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 116932774
6-(2-cyclopropyl-1-hydroxyethyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63107261
3-amino-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)propanenitrile
CID 116851226
6-(3-cyclopentyl-1-hydroxypropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63106693
6-[cycloheptyl(hydroxy)methyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 63106320
methyl 3-amino-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)propanoate
CID 116940125
6-[amino(azetidin-3-yl)methyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 116935319

Frequently Asked Questions

What is the IUPAC name of 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one (CID 63104828) is 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one is CN1C(=O)CCc2cc(C(N)CC3CCCC3)ccc21.
What is the InChIKey of 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one?
The InChIKey is HQNHROXTJZVRFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-19-16-8-6-13(11-14(16)7-9-17(19)20)15(18)10-12-4-2-3-5-12/h6,8,11-12,15H,2-5,7,9-10,18H2,1H3.
What are the key properties of 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one?
6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one has a molecular weight of 272.39 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-amino-2-cyclopentylethyl)-1-methyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 63104828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).