3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one

C15H20N2O2 — CID 84638203

IUPAC3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one
SMILESCc1c(CCN)c(=O)[nH]c2ccc(OC(C)C)cc12
InChIInChI=1S/C15H20N2O2/c1-9(2)19-11-4-5-14-13(8-11)10(3)12(6-7-16)15(18)17-14/h4-5,8-9H,6-7,16H2,1-3H3,(H,17,18)
InChIKeyNGORQGXOHGPLFP-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.12
Rot. Bonds4

About 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one

3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one (PubChem CID 84638203) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one.

Molecular Properties

Compound Name3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one
PubChem CID84638203
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one
SMILESCc1c(CCN)c(=O)[nH]c2ccc(OC(C)C)cc12
InChIInChI=1S/C15H20N2O2/c1-9(2)19-11-4-5-14-13(8-11)10(3)12(6-7-16)15(18)17-14/h4-5,8-9H,6-7,16H2,1-3H3,(H,17,18)
InChIKeyNGORQGXOHGPLFP-UHFFFAOYSA-N
XLogP2.12
TPSA68.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-4-methyl-3-propyl-1H-quinolin-2-one
CID 118872268
2-ethyl-3-methyl-6-propan-2-yloxy-1H-quinolin-4-one
CID 55221673
6-propan-2-yloxy-1,4-dihydroquinoxaline-2,3-dione
CID 146342056
8-(2-aminoethyl)-9-methyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
CID 84638095
3-(2-aminoethyl)-6-methoxy-4,8-dimethyl-1H-quinolin-2-one
CID 84632299
2-(1,2-dimethyl-5-propan-2-yloxyindol-3-yl)ethanamine
CID 82498330
2-(2-methyl-4-oxo-6-propan-2-yloxy-1H-quinolin-3-yl)acetic acid
CID 82248182
3-(5-methoxy-3-methyl-1H-indol-2-yl)-2-methylpropanoic acid
CID 84632755
4-oxo-6-propan-2-yloxy-1H-quinoline-2-carbonitrile
CID 82242632
(3-ethyl-4-methyl-2-oxo-1H-quinolin-7-yl) acetate
CID 46907086
3-(3-hydroxybutyl)-4-methyl-1H-quinolin-2-one
CID 3117151
2-[5-(4-propan-2-yloxyphenyl)-1H-indol-3-yl]ethanamine;hydrochloride
CID 75366101

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one?
The IUPAC name of 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one (CID 84638203) is 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one.
What is the SMILES notation for 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one?
The canonical SMILES for 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one is Cc1c(CCN)c(=O)[nH]c2ccc(OC(C)C)cc12.
What is the InChIKey of 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one?
The InChIKey is NGORQGXOHGPLFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-9(2)19-11-4-5-14-13(8-11)10(3)12(6-7-16)15(18)17-14/h4-5,8-9H,6-7,16H2,1-3H3,(H,17,18).
What are the key properties of 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one?
3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one has a molecular weight of 260.34 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-4-methyl-6-propan-2-yloxy-1H-quinolin-2-one is sourced from PubChem (CID 84638203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).