1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one

C10H13N5O2 — CID 141227679

IUPAC1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2ccccc2N1ON1CNNN1
InChIInChI=1S/C10H13N5O2/c16-10-6-5-8-3-1-2-4-9(8)15(10)17-14-7-11-12-13-14/h1-4,11-13H,5-7H2
InChIKeyDCVYDOPCCZBTNV-UHFFFAOYSA-N
MW235.25 g/mol
LogP-0.40
Rot. Bonds2

About 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one

1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one (PubChem CID 141227679) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one
PubChem CID141227679
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC Name1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2ccccc2N1ON1CNNN1
InChIInChI=1S/C10H13N5O2/c16-10-6-5-8-3-1-2-4-9(8)15(10)17-14-7-11-12-13-14/h1-4,11-13H,5-7H2
InChIKeyDCVYDOPCCZBTNV-UHFFFAOYSA-N
XLogP-0.40
TPSA68.87 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-[4-[(2-oxo-3,4-dihydroquinolin-1-yl)oxy]butoxy]-3,4-dihydroquinolin-2-one
CID 69185939
1-(aminomethoxy)-3,4-dihydroquinolin-2-one;hydrochloride
CID 67793338
1-(3-chloro-2-nitrosopropoxy)-3,4-dihydroquinolin-2-one
CID 57023332
1-ethyl-3,4-dihydroquinolin-2-one
CID 14580225
1-[4-[(S)-phenylsulfinyl]butoxy]-3,4-dihydroquinolin-2-one
CID 70607968
1-piperidin-1-yl-3,4-dihydroquinolin-2-one
CID 19094699
benzyl 7-[(2-oxo-3,4-dihydroquinolin-1-yl)oxy]heptanoate
CID 70553378
1-(2-chloroethyl)-3,4-dihydroquinolin-2-one
CID 12992360
5-methyl-11,12-dihydrobenzo[c][1]benzazocin-6-one
CID 13447635
(2,5-dioxopyrrolidin-1-yl)oxy-phenylborinic acid
CID 175524257
1-[3-tert-butylimino-2-(hydroxyamino)propoxy]-3,4-dihydroquinolin-2-one
CID 57051183
methyl 3-(2-oxo-3,4-dihydroquinolin-1-yl)propanoate
CID 28940061

Frequently Asked Questions

What is the IUPAC name of 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one (CID 141227679) is 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one is O=C1CCc2ccccc2N1ON1CNNN1.
What is the InChIKey of 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one?
The InChIKey is DCVYDOPCCZBTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2/c16-10-6-5-8-3-1-2-4-9(8)15(10)17-14-7-11-12-13-14/h1-4,11-13H,5-7H2.
What are the key properties of 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one?
1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one has a molecular weight of 235.25 g/mol, XLogP of -0.40, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(tetrazolidin-1-yloxy)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 141227679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).