6-(1-methylcyclodecyl)-4-propan-2-yloxazinane

C18H35NO — CID 134220008

IUPAC6-(1-methylcyclodecyl)-4-propan-2-yloxazinane
SMILESCC(C)C1CNOC(C2(C)CCCCCCCCC2)C1
InChIInChI=1S/C18H35NO/c1-15(2)16-13-17(20-19-14-16)18(3)11-9-7-5-4-6-8-10-12-18/h15-17,19H,4-14H2,1-3H3
InChIKeyBGMPBJRMBMDCGG-UHFFFAOYSA-N
MW281.48 g/mol
LogP5.08
Rot. Bonds2

About 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane

6-(1-methylcyclodecyl)-4-propan-2-yloxazinane (PubChem CID 134220008) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane.

Molecular Properties

Compound Name6-(1-methylcyclodecyl)-4-propan-2-yloxazinane
PubChem CID134220008
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name6-(1-methylcyclodecyl)-4-propan-2-yloxazinane
SMILESCC(C)C1CNOC(C2(C)CCCCCCCCC2)C1
InChIInChI=1S/C18H35NO/c1-15(2)16-13-17(20-19-14-16)18(3)11-9-7-5-4-6-8-10-12-18/h15-17,19H,4-14H2,1-3H3
InChIKeyBGMPBJRMBMDCGG-UHFFFAOYSA-N
XLogP5.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.48
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,4S,6R)-1-methyl-4-propan-2-yl-7-oxabicyclo[4.1.0]heptane
CID 91751113
9-propan-2-yl-1,5-dioxaspiro[5.5]undecane
CID 6455055
2-(1-methylcyclohexyl)oxolane
CID 23594551
1,1-dimethyl-4-propan-2-ylcyclohexane;propan-2-ylcyclohexane
CID 165006340
2-(1-methylcycloheptyl)aziridine
CID 157088948
2-(1-methylcyclobutyl)oxirane
CID 178200623
1,1-di(propan-2-yl)cyclopentane;propan-2-ylcyclopentane
CID 167644574
(3R,4aS,5R,8aS)-5,8a-dimethyl-3-propan-2-yl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene
CID 154723915
3-(1-methylcyclodecyl)-7-propan-2-ylazocan-3-amine
CID 134220327
4,9-di(propan-2-yl)tricyclo[5.3.0.02,6]decane
CID 156686010
(5R)-2,2-dimethyl-5-propan-2-ylpiperidine
CID 139339152
3,7-dimethyl-5-(1-methylcycloundecyl)azocane
CID 155407572

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane?
The IUPAC name of 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane (CID 134220008) is 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane.
What is the SMILES notation for 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane?
The canonical SMILES for 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane is CC(C)C1CNOC(C2(C)CCCCCCCCC2)C1.
What is the InChIKey of 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane?
The InChIKey is BGMPBJRMBMDCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-15(2)16-13-17(20-19-14-16)18(3)11-9-7-5-4-6-8-10-12-18/h15-17,19H,4-14H2,1-3H3.
What are the key properties of 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane?
6-(1-methylcyclodecyl)-4-propan-2-yloxazinane has a molecular weight of 281.48 g/mol, XLogP of 5.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylcyclodecyl)-4-propan-2-yloxazinane is sourced from PubChem (CID 134220008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).