N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide

C17H24N2O3 — CID 18952427

IUPACN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide
SMILESCC1(C)CC(=O)Nc2cc(NC(=O)CCCCCO)ccc21
InChIInChI=1S/C17H24N2O3/c1-17(2)11-16(22)19-14-10-12(7-8-13(14)17)18-15(21)6-4-3-5-9-20/h7-8,10,20H,3-6,9,11H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyHCXJMJNNWNOXCU-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.80
Rot. Bonds6

About N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide

N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide (PubChem CID 18952427) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide.

Molecular Properties

Compound NameN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide
PubChem CID18952427
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide
SMILESCC1(C)CC(=O)Nc2cc(NC(=O)CCCCCO)ccc21
InChIInChI=1S/C17H24N2O3/c1-17(2)11-16(22)19-14-10-12(7-8-13(14)17)18-15(21)6-4-3-5-9-20/h7-8,10,20H,3-6,9,11H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyHCXJMJNNWNOXCU-UHFFFAOYSA-N
XLogP2.80
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)heptanamide
CID 18952407
3-cyclopentyl-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-6-yl)propanamide
CID 75361156
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-3-pyridin-4-ylprop-2-enamide
CID 67823812
7-amino-N-(2-oxo-1,3-dihydroindol-5-yl)heptanamide
CID 119709201
7-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)heptanamide;hydrochloride
CID 119788407
5-hydroxy-N-(2,3,3-trimethyl-1-propan-2-yl-2H-indol-6-yl)pentanamide
CID 146564499
4-cyano-N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)benzamide
CID 18952439
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-3-prop-2-enoxybenzamide
CID 18952446
N-(2,3-dihydro-1H-inden-5-yl)-5-hydroxypentanamide
CID 79199175
3-[(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)amino]-1-(2-hydroxyethyl)pyrrole-2,5-dione
CID 168556796
4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 22690108
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-2-pyridin-3-ylprop-2-enamide
CID 18952464

Frequently Asked Questions

What is the IUPAC name of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide?
The IUPAC name of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide (CID 18952427) is N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide.
What is the SMILES notation for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide?
The canonical SMILES for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide is CC1(C)CC(=O)Nc2cc(NC(=O)CCCCCO)ccc21.
What is the InChIKey of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide?
The InChIKey is HCXJMJNNWNOXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-17(2)11-16(22)19-14-10-12(7-8-13(14)17)18-15(21)6-4-3-5-9-20/h7-8,10,20H,3-6,9,11H2,1-2H3,(H,18,21)(H,19,22).
What are the key properties of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide?
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide has a molecular weight of 304.39 g/mol, XLogP of 2.80, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-7-yl)-6-hydroxyhexanamide is sourced from PubChem (CID 18952427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).