(3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride

C10H13ClN2O — CID 69196199

IUPAC(3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride
SMILESCN1C(=O)[C@H](N)Cc2ccccc21.Cl
InChIInChI=1S/C10H12N2O.ClH/c1-12-9-5-3-2-4-7(9)6-8(11)10(12)13;/h2-5,8H,6,11H2,1H3;1H/t8-;/m1./s1
InChIKeyIXPKJDGJYDFJDU-DDWIOCJRSA-N
MW212.68 g/mol
LogP0.95
Rot. Bonds

About (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride

(3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride (PubChem CID 69196199) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride.

Molecular Properties

Compound Name(3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride
PubChem CID69196199
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC Name(3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride
SMILESCN1C(=O)[C@H](N)Cc2ccccc21.Cl
InChIInChI=1S/C10H12N2O.ClH/c1-12-9-5-3-2-4-7(9)6-8(11)10(12)13;/h2-5,8H,6,11H2,1H3;1H/t8-;/m1./s1
InChIKeyIXPKJDGJYDFJDU-DDWIOCJRSA-N
XLogP0.95
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

3-(aminomethyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 54772600
ethane;1,3,4-trimethyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 123732001
3-amino-1,5-dimethyl-1,5-benzodiazepine-2,4-dione
CID 22312383
3-amino-1,5-dimethyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 22312414
3-cyclopropyloxy-1-methyl-3,4-dihydroquinolin-2-one
CID 141043547
(3R)-3-amino-1-benzyl-3,4-dihydroquinolin-2-one
CID 178034232
(3S)-3-amino-1-methylspiro[3,4-dihydro-1-benzazepine-5,1'-cyclopropane]-2-one;hydrochloride
CID 140844145
3-amino-1-methyl-5-methylsulfonyl-3,4-dihydro-1,5-benzodiazepin-2-one;hydrochloride
CID 21072579
2-(3-amino-2-oxo-3,4-dihydroquinolin-1-yl)-N,N-dimethylacetamide
CID 68898482
CID 142801731
CID 142801731
(3S)-3-amino-1-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]-3,4-dihydroquinolin-2-one
CID 129384424
1,3-dimethyl-4,5-dihydro-3H-1,4-benzodiazepin-2-one
CID 59848827

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride?
The IUPAC name of (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride (CID 69196199) is (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride.
What is the SMILES notation for (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride?
The canonical SMILES for (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride is CN1C(=O)[C@H](N)Cc2ccccc21.Cl.
What is the InChIKey of (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride?
The InChIKey is IXPKJDGJYDFJDU-DDWIOCJRSA-N. The full InChI is InChI=1S/C10H12N2O.ClH/c1-12-9-5-3-2-4-7(9)6-8(11)10(12)13;/h2-5,8H,6,11H2,1H3;1H/t8-;/m1./s1.
What are the key properties of (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride?
(3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride has a molecular weight of 212.68 g/mol, XLogP of 0.95, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-1-methyl-3,4-dihydroquinolin-2-one;hydrochloride is sourced from PubChem (CID 69196199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).