8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane

C15H30N2 — CID 155171561

IUPAC8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane
SMILESCC(C)C(C)(C(C)C)N1CC2CCC(C1)N2C
InChIInChI=1S/C15H30N2/c1-11(2)15(5,12(3)4)17-9-13-7-8-14(10-17)16(13)6/h11-14H,7-10H2,1-6H3
InChIKeyMMRWIJHQWINPGC-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.84
Rot. Bonds3

About 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane

8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane (PubChem CID 155171561) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane
PubChem CID155171561
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane
SMILESCC(C)C(C)(C(C)C)N1CC2CCC(C1)N2C
InChIInChI=1S/C15H30N2/c1-11(2)15(5,12(3)4)17-9-13-7-8-14(10-17)16(13)6/h11-14H,7-10H2,1-6H3
InChIKeyMMRWIJHQWINPGC-UHFFFAOYSA-N
XLogP2.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane?
The IUPAC name of 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane (CID 155171561) is 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane.
What is the SMILES notation for 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane?
The canonical SMILES for 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane is CC(C)C(C)(C(C)C)N1CC2CCC(C1)N2C.
What is the InChIKey of 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane?
The InChIKey is MMRWIJHQWINPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-11(2)15(5,12(3)4)17-9-13-7-8-14(10-17)16(13)6/h11-14H,7-10H2,1-6H3.
What are the key properties of 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane?
8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane has a molecular weight of 238.42 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-(2,3,4-trimethylpentan-3-yl)-3,8-diazabicyclo[3.2.1]octane is sourced from PubChem (CID 155171561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).