4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one

C13H18N2O2 — CID 43776299

IUPAC4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCC(O)CNC1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C13H18N2O2/c1-9(16)8-14-11-7-13(17)15(2)12-6-4-3-5-10(11)12/h3-6,9,11,14,16H,7-8H2,1-2H3
InChIKeyLGIUOUVQCHCHIW-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.06
Rot. Bonds3

About 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one

4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one (PubChem CID 43776299) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one
PubChem CID43776299
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCC(O)CNC1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C13H18N2O2/c1-9(16)8-14-11-7-13(17)15(2)12-6-4-3-5-10(11)12/h3-6,9,11,14,16H,7-8H2,1-2H3
InChIKeyLGIUOUVQCHCHIW-UHFFFAOYSA-N
XLogP1.06
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-(2-methylsulfanylpropylamino)-3,4-dihydroquinolin-2-one
CID 115895572
4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one
CID 115718008
4-[(2-hydroxy-4,4-dimethylpentyl)amino]-1-methyl-3,4-dihydroquinolin-2-one
CID 103784381
1-methyl-4-[(1-propan-2-ylcyclopropyl)methylamino]-3,4-dihydroquinolin-2-one
CID 103903270
4-[(4-hydroxyphenyl)methylamino]-1-methyl-3,4-dihydroquinolin-2-one
CID 115715625
4-[(2-hydroxy-2-methylbutyl)amino]-1-methyl-3,4-dihydroquinolin-2-one
CID 65102974
1-methyl-4-(3-propan-2-yloxypropylamino)-3,4-dihydroquinolin-2-one
CID 43771415
4-(cyclobutylmethylamino)-1-methyl-3,4-dihydroquinolin-2-one
CID 43775263
2-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)amino]ethylurea
CID 83110177
1-methyl-4-(pentan-3-ylamino)-3,4-dihydroquinolin-2-one
CID 43756603
4-[(2-fluorophenyl)methylamino]-1-methyl-3,4-dihydroquinolin-2-one
CID 43763715
1-methyl-4-(3-methylsulfanylpropylamino)-3,4-dihydroquinolin-2-one
CID 63981224

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one (CID 43776299) is 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one is CC(O)CNC1CC(=O)N(C)c2ccccc21.
What is the InChIKey of 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one?
The InChIKey is LGIUOUVQCHCHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9(16)8-14-11-7-13(17)15(2)12-6-4-3-5-10(11)12/h3-6,9,11,14,16H,7-8H2,1-2H3.
What are the key properties of 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one?
4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one has a molecular weight of 234.30 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 43776299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).