8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane

C11H21N — CID 142386523

IUPAC8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane
SMILESCC(C)C1(C)C2CCC1CNC2
InChIInChI=1S/C11H21N/c1-8(2)11(3)9-4-5-10(11)7-12-6-9/h8-10,12H,4-7H2,1-3H3
InChIKeyAPYFCPWOASVDFL-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.28
Rot. Bonds1

About 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane

8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane (PubChem CID 142386523) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane
PubChem CID142386523
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane
SMILESCC(C)C1(C)C2CCC1CNC2
InChIInChI=1S/C11H21N/c1-8(2)11(3)9-4-5-10(11)7-12-6-9/h8-10,12H,4-7H2,1-3H3
InChIKeyAPYFCPWOASVDFL-UHFFFAOYSA-N
XLogP2.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-fluoro-6-methyl-3-azabicyclo[3.1.0]hexane
CID 130919289
8-fluoro-8-methyl-6-propan-2-yl-3,6-diazabicyclo[3.2.1]octane
CID 105442285
7,7-di(propan-2-yl)-3-azabicyclo[4.1.1]octane
CID 58352776
4-cyclopropyl-4-methylpiperidine
CID 63156417
8-fluoro-8-methyl-6λ6-thia-3-azabicyclo[3.2.1]octane 6,6-dioxide
CID 105446953
molecular hydrogen;1-propan-2-yl-3-azabicyclo[3.1.0]hexane
CID 144912446
3-(1-bromoethyl)azetidine
CID 167740275
6-propan-2-yl-3-azabicyclo[3.2.0]heptan-6-ol
CID 58456370
3,8-dimethyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane;(1S,5R)-3-propan-2-yl-8-thiabicyclo[3.2.1]octan-3-ol;bis((1R,5R)-3-propan-2-yl-8-thiabicyclo[3.2.1]octan-3-ol)
CID 158356321
(3S,4S)-3,4-dimethyl-3-propan-2-ylpyrrolidine
CID 118444596
(1S,5S)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane
CID 23309189
(4R)-3,4-dimethyl-3-propan-2-ylpyrrolidine
CID 135170137

Frequently Asked Questions

What is the IUPAC name of 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane?
The IUPAC name of 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane (CID 142386523) is 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane is CC(C)C1(C)C2CCC1CNC2.
What is the InChIKey of 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane?
The InChIKey is APYFCPWOASVDFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-8(2)11(3)9-4-5-10(11)7-12-6-9/h8-10,12H,4-7H2,1-3H3.
What are the key properties of 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane?
8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane has a molecular weight of 167.30 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-8-propan-2-yl-3-azabicyclo[3.2.1]octane is sourced from PubChem (CID 142386523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).