1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one

C14H18N2O2 — CID 11831725

IUPAC1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one
SMILESCC1Oc2ncccc2N(C2CCCCC2)C1=O
InChIInChI=1S/C14H18N2O2/c1-10-14(17)16(11-6-3-2-4-7-11)12-8-5-9-15-13(12)18-10/h5,8-11H,2-4,6-7H2,1H3
InChIKeyIQSTXPAQHXLFRT-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.53
Rot. Bonds1

About 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one

1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one (PubChem CID 11831725) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one.

Molecular Properties

Compound Name1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one
PubChem CID11831725
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one
SMILESCC1Oc2ncccc2N(C2CCCCC2)C1=O
InChIInChI=1S/C14H18N2O2/c1-10-14(17)16(11-6-3-2-4-7-11)12-8-5-9-15-13(12)18-10/h5,8-11H,2-4,6-7H2,1H3
InChIKeyIQSTXPAQHXLFRT-UHFFFAOYSA-N
XLogP2.53
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 125418523
3-methyl-2-(2-methyl-3-pyridinyl)-3,6,7,8,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione
CID 79932394
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2-(2-chloroethyl)-4-cyclohexyl-2,3-dihydropyrido[3,2-f][1,4]oxazepin-5-one;hydrochloride
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benzylbenzene;1-cyclohexyl-3,4-dimethylpyrrolidine-2,5-dione;ethane
CID 167545184
2-cyclodecylisoindole-1,3-dione
CID 123786237
7-amino-4-cyclopentyl-2-methyl-1,4-benzothiazin-3-one
CID 84615562
10-(1,1-dimethyl-9-pyrido[3,2-b][1,4]benzothiazin-10-ylazecan-1-ium-3-yl)pyrido[3,2-b][1,4]benzothiazine
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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one?
The IUPAC name of 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one (CID 11831725) is 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one.
What is the SMILES notation for 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one?
The canonical SMILES for 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one is CC1Oc2ncccc2N(C2CCCCC2)C1=O.
What is the InChIKey of 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one?
The InChIKey is IQSTXPAQHXLFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-10-14(17)16(11-6-3-2-4-7-11)12-8-5-9-15-13(12)18-10/h5,8-11H,2-4,6-7H2,1H3.
What are the key properties of 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one?
1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one has a molecular weight of 246.31 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-methylpyrido[2,3-b][1,4]oxazin-2-one is sourced from PubChem (CID 11831725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).