6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one

C14H15N5O2 — CID 80909861

IUPAC6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one
SMILESCc1cc(Oc2ccc3c(c2)CCC(=O)N3)nc(NN)n1
InChIInChI=1S/C14H15N5O2/c1-8-6-13(18-14(16-8)19-15)21-10-3-4-11-9(7-10)2-5-12(20)17-11/h3-4,6-7H,2,5,15H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyYUPSQIYBYZPWEW-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.75
Rot. Bonds3

About 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one

6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 80909861) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID80909861
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC Name6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one
SMILESCc1cc(Oc2ccc3c(c2)CCC(=O)N3)nc(NN)n1
InChIInChI=1S/C14H15N5O2/c1-8-6-13(18-14(16-8)19-15)21-10-3-4-11-9(7-10)2-5-12(20)17-11/h3-4,6-7H,2,5,15H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyYUPSQIYBYZPWEW-UHFFFAOYSA-N
XLogP1.75
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-(2-hydrazinylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 80917841
6-(2-amino-6-chloropyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 112725503
6-(6-amino-2-methylsulfanylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 80865473
6-[(5-amino-4-methyl-2-pyridinyl)oxy]-3,4-dihydro-1H-quinolin-2-one
CID 79175974
6-[[6-(ethylamino)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
CID 80865656
6-[4-[(1R)-1-hydroxyethyl]phenoxy]-3,4-dihydro-1H-quinolin-2-one
CID 78938613
6-[(6-methoxy-3-pyridinyl)oxy]-3,4-dihydro-1H-quinolin-2-one
CID 166453240
[4-(3,5-dimethylphenoxy)-6-methylpyrimidin-2-yl]hydrazine
CID 80915689
6-[6-methyl-2-(methylamino)pyrimidin-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 116894637
[4-(3-iodophenoxy)-6-methylpyrimidin-2-yl]hydrazine
CID 80916371
4-(2,3-dihydro-1H-indol-5-yloxy)-6-methylpyrimidin-2-amine
CID 59596374
2-methyl-4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]benzonitrile
CID 81273879

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one (CID 80909861) is 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one is Cc1cc(Oc2ccc3c(c2)CCC(=O)N3)nc(NN)n1.
What is the InChIKey of 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is YUPSQIYBYZPWEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-8-6-13(18-14(16-8)19-15)21-10-3-4-11-9(7-10)2-5-12(20)17-11/h3-4,6-7H,2,5,15H2,1H3,(H,17,20)(H,16,18,19).
What are the key properties of 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one?
6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 285.31 g/mol, XLogP of 1.75, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydrazinyl-6-methylpyrimidin-4-yl)oxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 80909861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).