10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane

C19H35NO — CID 134213203

IUPAC10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane
SMILESCN1C2CCCCCCC(CC2)OC2CCCCCC1C2
InChIInChI=1S/C19H35NO/c1-20-16-9-5-2-3-7-11-18(14-13-16)21-19-12-8-4-6-10-17(20)15-19/h16-19H,2-15H2,1H3
InChIKeyJCCNHASFZMAVDJ-UHFFFAOYSA-N
MW293.50 g/mol
LogP4.91
Rot. Bonds

About 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane

10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane (PubChem CID 134213203) has the molecular formula C19H35NO and a molecular weight of 293.50 g/mol. Its IUPAC name is 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane.

Molecular Properties

Compound Name10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane
PubChem CID134213203
Molecular FormulaC19H35NO
Molecular Weight293.50 g/mol
Exact Mass293.27
IUPAC Name10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane
SMILESCN1C2CCCCCCC(CC2)OC2CCCCCC1C2
InChIInChI=1S/C19H35NO/c1-20-16-9-5-2-3-7-11-18(14-13-16)21-19-12-8-4-6-10-17(20)15-19/h16-19H,2-15H2,1H3
InChIKeyJCCNHASFZMAVDJ-UHFFFAOYSA-N
XLogP4.91
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-10-methyl-2-oxa-10-azatricyclo[9.6.2.23,9]henicosane
CID 170097259
(7S)-12-methyl-12-azabicyclo[5.4.1]dodecane
CID 126565755
10-oxabicyclo[5.2.1]decane
CID 118210101
11-methyl-11-azabicyclo[4.4.1]undecane
CID 580203
10-methyl-10-azatricyclo[9.6.2.12,9]icosane
CID 134213267
methane;7-methyl-7-azabicyclo[2.2.1]heptane;8-methyl-8-azabicyclo[3.2.1]octane
CID 157389417
(5R)-6-methyl-6-azabicyclo[3.1.1]heptane
CID 176941052
2-methyl-2,11-diazatricyclo[10.8.2.13,10]tricosane
CID 138644443
CID 157364506
CID 157364506
8-methyl-8-azabicyclo[3.2.1]octane;2-methylpropane
CID 177033285
3-cyclohexyl-6-oxa-3-azabicyclo[3.1.1]heptane
CID 156712366
(1R,5S)-N-cyclohexyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 667781

Frequently Asked Questions

What is the IUPAC name of 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane?
The IUPAC name of 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane (CID 134213203) is 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane.
What is the SMILES notation for 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane?
The canonical SMILES for 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane is CN1C2CCCCCCC(CC2)OC2CCCCCC1C2.
What is the InChIKey of 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane?
The InChIKey is JCCNHASFZMAVDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO/c1-20-16-9-5-2-3-7-11-18(14-13-16)21-19-12-8-4-6-10-17(20)15-19/h16-19H,2-15H2,1H3.
What are the key properties of 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane?
10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane has a molecular weight of 293.50 g/mol, XLogP of 4.91, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-2-oxa-10-azatricyclo[9.6.2.13,9]icosane is sourced from PubChem (CID 134213203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).