8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane

C17H31NO — CID 170386316

IUPAC8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane
SMILESCC(C)(C)OC[C@@H](CN1C2CCCC1CC2)C1CC1
InChIInChI=1S/C17H31NO/c1-17(2,3)19-12-14(13-7-8-13)11-18-15-5-4-6-16(18)10-9-15/h13-16H,4-12H2,1-3H3/t14-,15?,16?/m1/s1
InChIKeyOUNIELDXWUVVRG-QQFBHYJXSA-N
MW265.44 g/mol
LogP3.84
Rot. Bonds5

About 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane

8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane (PubChem CID 170386316) has the molecular formula C17H31NO and a molecular weight of 265.44 g/mol. Its IUPAC name is 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane
PubChem CID170386316
Molecular FormulaC17H31NO
Molecular Weight265.44 g/mol
Exact Mass265.24
IUPAC Name8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane
SMILESCC(C)(C)OC[C@@H](CN1C2CCCC1CC2)C1CC1
InChIInChI=1S/C17H31NO/c1-17(2,3)19-12-14(13-7-8-13)11-18-15-5-4-6-16(18)10-9-15/h13-16H,4-12H2,1-3H3/t14-,15?,16?/m1/s1
InChIKeyOUNIELDXWUVVRG-QQFBHYJXSA-N
XLogP3.84
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane 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-[(2S)-2-methoxy-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane
CID 170385950
8-[(2R)-2-methoxy-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane
CID 170385951
3-[1-[(2-methylpropan-2-yl)oxy]butan-2-yl]azetidine
CID 135243155
1-cyclobutyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 105100757
1-(2-methyl-4-propan-2-yloxybutan-2-yl)oxybutan-2-ylcyclobutane
CID 155392929
1-(7-azabicyclo[2.2.1]heptan-7-yl)-3,3-dimethylbutan-2-ol
CID 131162882
(2S)-1-(4-cyclopropyl-1,4-diazepan-1-yl)-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 97210895
(2S)-1-cyclopentyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 157185666
1-(4-methylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105102501
3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane
CID 146339853
1-[(2-methylpropan-2-yl)oxy]-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propan-2-ol
CID 110898534
2-[(2-methylpropan-2-yl)oxy]-1-(oxan-4-yl)ethanamine
CID 105147172

Frequently Asked Questions

What is the IUPAC name of 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane (CID 170386316) is 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane is CC(C)(C)OC[C@@H](CN1C2CCCC1CC2)C1CC1.
What is the InChIKey of 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane?
The InChIKey is OUNIELDXWUVVRG-QQFBHYJXSA-N. The full InChI is InChI=1S/C17H31NO/c1-17(2,3)19-12-14(13-7-8-13)11-18-15-5-4-6-16(18)10-9-15/h13-16H,4-12H2,1-3H3/t14-,15?,16?/m1/s1.
What are the key properties of 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane?
8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane has a molecular weight of 265.44 g/mol, XLogP of 3.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2R)-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propyl]-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 170386316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).