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

C15H15N3O2 — CID 16793550

IUPAC6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
SMILESNCc1cccnc1Oc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H15N3O2/c16-9-11-2-1-7-17-15(11)20-12-4-5-13-10(8-12)3-6-14(19)18-13/h1-2,4-5,7-8H,3,6,9,16H2,(H,18,19)
InChIKeyKFMZFCRPMSLQAG-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.22
Rot. Bonds3

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

6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 16793550) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID16793550
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
SMILESNCc1cccnc1Oc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H15N3O2/c16-9-11-2-1-7-17-15(11)20-12-4-5-13-10(8-12)3-6-14(19)18-13/h1-2,4-5,7-8H,3,6,9,16H2,(H,18,19)
InChIKeyKFMZFCRPMSLQAG-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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Frequently Asked Questions

What is the IUPAC name of 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one (CID 16793550) is 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one is NCc1cccnc1Oc1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is KFMZFCRPMSLQAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-9-11-2-1-7-17-15(11)20-12-4-5-13-10(8-12)3-6-14(19)18-13/h1-2,4-5,7-8H,3,6,9,16H2,(H,18,19).
What are the key properties of 6-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one?
6-[[3-(aminomethyl)-2-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-[[3-(aminomethyl)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 16793550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).