6-(cyclopropylmethoxy)-1H-quinolin-2-one

C13H13NO2 — CID 68861342

IUPAC6-(cyclopropylmethoxy)-1H-quinolin-2-one
SMILESO=c1ccc2cc(OCC3CC3)ccc2[nH]1
InChIInChI=1S/C13H13NO2/c15-13-6-3-10-7-11(4-5-12(10)14-13)16-8-9-1-2-9/h3-7,9H,1-2,8H2,(H,14,15)
InChIKeyYKUMGCNZZYCXOR-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.32
Rot. Bonds3

About 6-(cyclopropylmethoxy)-1H-quinolin-2-one

6-(cyclopropylmethoxy)-1H-quinolin-2-one (PubChem CID 68861342) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-1H-quinolin-2-one
PubChem CID68861342
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name6-(cyclopropylmethoxy)-1H-quinolin-2-one
SMILESO=c1ccc2cc(OCC3CC3)ccc2[nH]1
InChIInChI=1S/C13H13NO2/c15-13-6-3-10-7-11(4-5-12(10)14-13)16-8-9-1-2-9/h3-7,9H,1-2,8H2,(H,14,15)
InChIKeyYKUMGCNZZYCXOR-UHFFFAOYSA-N
XLogP2.32
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-1H-quinolin-2-one?
The IUPAC name of 6-(cyclopropylmethoxy)-1H-quinolin-2-one (CID 68861342) is 6-(cyclopropylmethoxy)-1H-quinolin-2-one.
What is the SMILES notation for 6-(cyclopropylmethoxy)-1H-quinolin-2-one?
The canonical SMILES for 6-(cyclopropylmethoxy)-1H-quinolin-2-one is O=c1ccc2cc(OCC3CC3)ccc2[nH]1.
What is the InChIKey of 6-(cyclopropylmethoxy)-1H-quinolin-2-one?
The InChIKey is YKUMGCNZZYCXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c15-13-6-3-10-7-11(4-5-12(10)14-13)16-8-9-1-2-9/h3-7,9H,1-2,8H2,(H,14,15).
What are the key properties of 6-(cyclopropylmethoxy)-1H-quinolin-2-one?
6-(cyclopropylmethoxy)-1H-quinolin-2-one has a molecular weight of 215.25 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-1H-quinolin-2-one is sourced from PubChem (CID 68861342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).