[3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol

C12H21NO — CID 130671349

IUPAC[3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol
SMILESOCC1C2CCC(C2)C1NC1CCC1
InChIInChI=1S/C12H21NO/c14-7-11-8-4-5-9(6-8)12(11)13-10-2-1-3-10/h8-14H,1-7H2
InChIKeySCDGHHCGJRIVQS-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.54
Rot. Bonds3

About [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol

[3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol (PubChem CID 130671349) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol.

Molecular Properties

Compound Name[3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol
PubChem CID130671349
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name[3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol
SMILESOCC1C2CCC(C2)C1NC1CCC1
InChIInChI=1S/C12H21NO/c14-7-11-8-4-5-9(6-8)12(11)13-10-2-1-3-10/h8-14H,1-7H2
InChIKeySCDGHHCGJRIVQS-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol?
The IUPAC name of [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol (CID 130671349) is [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol.
What is the SMILES notation for [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol?
The canonical SMILES for [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol is OCC1C2CCC(C2)C1NC1CCC1.
What is the InChIKey of [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol?
The InChIKey is SCDGHHCGJRIVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c14-7-11-8-4-5-9(6-8)12(11)13-10-2-1-3-10/h8-14H,1-7H2.
What are the key properties of [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol?
[3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol has a molecular weight of 195.31 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(cyclobutylamino)-2-bicyclo[2.2.1]heptanyl]methanol is sourced from PubChem (CID 130671349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).