8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane

C11H17N — CID 171951393

IUPAC8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane
SMILESC=CC=C1CC2CCC(C1)N2C
InChIInChI=1S/C11H17N/c1-3-4-9-7-10-5-6-11(8-9)12(10)2/h3-4,10-11H,1,5-8H2,2H3
InChIKeyHBBADUDHFJXMRP-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.36
Rot. Bonds1

About 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane

8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane (PubChem CID 171951393) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane
PubChem CID171951393
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane
SMILESC=CC=C1CC2CCC(C1)N2C
InChIInChI=1S/C11H17N/c1-3-4-9-7-10-5-6-11(8-9)12(10)2/h3-4,10-11H,1,5-8H2,2H3
InChIKeyHBBADUDHFJXMRP-UHFFFAOYSA-N
XLogP2.36
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(1E,3Z,5Z)-3-(1-fluoroethyl)hepta-1,3,5-trienyl]-8-methyl-8-azabicyclo[3.2.1]octane
CID 89022338
8-[(2,6-Difluorocyclohexa-2,4-dien-1-yl)methyl]-8-azabicyclo[3.2.1]octane
CID 123957186
(1S,5S)-8-[(2-fluorocyclohexa-2,4-dien-1-yl)methyl]-8-azabicyclo[3.2.1]octane
CID 144347641
(2R,4R)-4-fluoro-2-[(3Z,5Z)-hepta-1,3,5-trien-2-yl]-1-propan-2-ylpiperidine
CID 156470413
2-[(3E,5E)-5-fluorohepta-1,3,5-trien-3-yl]-1-methylpiperidine
CID 166963559
Acetonitrile, (8-methyl-8-azabicyclo[3.2.1]oct-3-ylidene)-
CID 18940988
8-Methyl-3-propylidene-8-azabicyclo[3.2.1]octane
CID 20594127
3-Butan-2-ylidene-8-ethyl-8-azabicyclo[3.2.1]octane;yttrium
CID 59813161
3,8-Diethyl-8-azabicyclo[3.2.1]oct-2-ene
CID 60021048
(2S)-2-(cyclohexa-1,3-dien-1-ylmethyl)-1-methylpyrrolidine
CID 66612926
2-Cyclohexa-1,5-dien-1-yl-1-methylpyrrolidine
CID 68312159
(1R,5S)-8-(cyclopenta-1,3-dien-1-ylmethyl)-8-azabicyclo[3.2.1]octane
CID 70131256

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane (CID 171951393) is 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane is C=CC=C1CC2CCC(C1)N2C.
What is the InChIKey of 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane?
The InChIKey is HBBADUDHFJXMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-3-4-9-7-10-5-6-11(8-9)12(10)2/h3-4,10-11H,1,5-8H2,2H3.
What are the key properties of 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane?
8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane has a molecular weight of 163.26 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-prop-2-enylidene-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 171951393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).