[8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol

C13H26N2O — CID 61054946

IUPAC[8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol
SMILESCC(C)CNC1(CO)CC2CCC(C1)N2C
InChIInChI=1S/C13H26N2O/c1-10(2)8-14-13(9-16)6-11-4-5-12(7-13)15(11)3/h10-12,14,16H,4-9H2,1-3H3
InChIKeyJUFHSJUPAUMGEX-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.22
Rot. Bonds4

About [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol

[8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol (PubChem CID 61054946) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol.

Molecular Properties

Compound Name[8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol
PubChem CID61054946
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol
SMILESCC(C)CNC1(CO)CC2CCC(C1)N2C
InChIInChI=1S/C13H26N2O/c1-10(2)8-14-13(9-16)6-11-4-5-12(7-13)15(11)3/h10-12,14,16H,4-9H2,1-3H3
InChIKeyJUFHSJUPAUMGEX-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(8-Methyl-8-azabicyclo(3.2.1)octan-3-yl)methanol
CID 22056633
rac-((1R,3R,5S)-8-azabicyclo(3.2.1)octan-3-yl)methanol hydrochloride
CID 71464259
1-Oxy-2,2,6,6-tetramethyl 4-aminopiperidine
CID 129867459
(1R,3S,5S)-8-Azabicyclo[3.2.1]octan-3-ylmethanol
CID 51893254
[8-Methyl-3-(2,2,2-trifluoroethylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol
CID 61045469
[7-(2,2,2-trifluoroethylamino)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-yl]methanol
CID 81611833
2-[4-Amino-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-3-yl]ethanol
CID 21328260
8-Azabicyclo[3.2.1]octan-3-ylmethanol
CID 45792697
[8-(Propan-2-yl)-8-azabicyclo[3.2.1]octan-3-yl]methanol
CID 45792716
1-Piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol
CID 54143780
((1R,5S)-8-Methyl-8-azabicyclo(3.2.1)octan-3-yl)methanol
CID 66570658
8-Azabicyclo[3.2.1]octan-3-ylmethanol hydrochloride
CID 67505891

Frequently Asked Questions

What is the IUPAC name of [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol?
The IUPAC name of [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol (CID 61054946) is [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol.
What is the SMILES notation for [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol?
The canonical SMILES for [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol is CC(C)CNC1(CO)CC2CCC(C1)N2C.
What is the InChIKey of [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol?
The InChIKey is JUFHSJUPAUMGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10(2)8-14-13(9-16)6-11-4-5-12(7-13)15(11)3/h10-12,14,16H,4-9H2,1-3H3.
What are the key properties of [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol?
[8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [8-methyl-3-(2-methylpropylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol is sourced from PubChem (CID 61054946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).