6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one

C15H15N3O2 — CID 115487140

IUPAC6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
SMILESNCc1ccc(Oc2ccc3c(c2)CCC(=O)N3)cn1
InChIInChI=1S/C15H15N3O2/c16-8-11-2-3-13(9-17-11)20-12-4-5-14-10(7-12)1-6-15(19)18-14/h2-5,7,9H,1,6,8,16H2,(H,18,19)
InChIKeyZJCQBGUARGRESN-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.22
Rot. Bonds3

About 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one

6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 115487140) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID115487140
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
SMILESNCc1ccc(Oc2ccc3c(c2)CCC(=O)N3)cn1
InChIInChI=1S/C15H15N3O2/c16-8-11-2-3-13(9-17-11)20-12-4-5-14-10(7-12)1-6-15(19)18-14/h2-5,7,9H,1,6,8,16H2,(H,18,19)
InChIKeyZJCQBGUARGRESN-UHFFFAOYSA-N
XLogP2.22
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(6-methoxy-3-pyridinyl)oxy]-3,4-dihydro-1H-quinolin-2-one
CID 166453240
6-[4-(aminomethyl)-3-bromophenoxy]-3,4-dihydro-1H-quinolin-2-one
CID 107275127
6-(5-bromopyrimidin-2-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 63867081
6-[2-(aminomethyl)-4-chlorophenoxy]-3,4-dihydro-1H-quinolin-2-one
CID 62493675
6-[(5-amino-4-methyl-2-pyridinyl)oxy]-3,4-dihydro-1H-quinolin-2-one
CID 79175974
6-[2-(aminomethyl)-4-bromophenoxy]-3,4-dihydro-1H-quinolin-2-one
CID 114889839
4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid
CID 43325986
6-(1-amino-2-methylpropan-2-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 113422602
6-(1-methylindazol-5-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 166453232
6-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-3-carbonitrile
CID 24693753
6-[4-[(1R)-1-hydroxyethyl]phenoxy]-3,4-dihydro-1H-quinolin-2-one
CID 78938613
methyl 3-amino-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]propanoate
CID 114242135

Frequently Asked Questions

What is the IUPAC name of 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one (CID 115487140) is 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one is NCc1ccc(Oc2ccc3c(c2)CCC(=O)N3)cn1.
What is the InChIKey of 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is ZJCQBGUARGRESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-8-11-2-3-13(9-17-11)20-12-4-5-14-10(7-12)1-6-15(19)18-14/h2-5,7,9H,1,6,8,16H2,(H,18,19).
What are the key properties of 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 269.30 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[6-(aminomethyl)-3-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 115487140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).