(2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol

C10H19NO — CID 85287680

IUPAC(2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol
SMILESCC(C)N1C2CCC(C2)C1CO
InChIInChI=1S/C10H19NO/c1-7(2)11-9-4-3-8(5-9)10(11)6-12/h7-10,12H,3-6H2,1-2H3
InChIKeyBTVUSALZDDJPFW-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.24
Rot. Bonds2

About (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol

(2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol (PubChem CID 85287680) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol.

Molecular Properties

Compound Name(2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol
PubChem CID85287680
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol
SMILESCC(C)N1C2CCC(C2)C1CO
InChIInChI=1S/C10H19NO/c1-7(2)11-9-4-3-8(5-9)10(11)6-12/h7-10,12H,3-6H2,1-2H3
InChIKeyBTVUSALZDDJPFW-UHFFFAOYSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-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

3-(Fluoromethyl)-2-methyl-2-azabicyclo[2.2.1]heptan-6-ol
CID 118940547
[(3R)-2-(2,2-difluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl]methanol
CID 154643852
((1S,3R,4R)-2-(2-Fluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl)methanol
CID 154644167
[(3R,4R)-2-(2-fluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl]methanol
CID 154984387
[(1S,4R)-2-(2-fluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl]methanol
CID 154990503
((1S,3R,4R)-2-(2,2-Difluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl)methanol
CID 155211270
[(1S,3R,4S)-2-(2-fluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl]methanol
CID 155233333
[2-(2-Fluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl]methanol
CID 168880967
((1S,3R,4R)-2-Methyl-2-azabicyclo[2.2.1]heptan-3-yl)methanol
CID 10582877
2-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]ethanol
CID 10607223
2-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanol
CID 54218768
((1S,3S,4R)-2-(2-Fluoroethyl)-2-azabicyclo[2.2.1]heptan-3-yl)methanol
CID 168446344

Frequently Asked Questions

What is the IUPAC name of (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol?
The IUPAC name of (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol (CID 85287680) is (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol.
What is the SMILES notation for (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol?
The canonical SMILES for (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol is CC(C)N1C2CCC(C2)C1CO.
What is the InChIKey of (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol?
The InChIKey is BTVUSALZDDJPFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)11-9-4-3-8(5-9)10(11)6-12/h7-10,12H,3-6H2,1-2H3.
What are the key properties of (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol?
(2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol has a molecular weight of 169.27 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propan-2-yl-2-azabicyclo[2.2.1]heptan-3-yl)methanol is sourced from PubChem (CID 85287680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).