(2-amino-3-bicyclo[3.3.1]nonanyl)methanol

C10H19NO — CID 89331972

IUPAC(2-amino-3-bicyclo[3.3.1]nonanyl)methanol
SMILESNC1C(CO)CC2CCCC1C2
InChIInChI=1S/C10H19NO/c11-10-8-3-1-2-7(4-8)5-9(10)6-12/h7-10,12H,1-6,11H2
InChIKeyWPRKDNZGAYLWTF-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.13
Rot. Bonds1

About (2-amino-3-bicyclo[3.3.1]nonanyl)methanol

(2-amino-3-bicyclo[3.3.1]nonanyl)methanol (PubChem CID 89331972) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2-amino-3-bicyclo[3.3.1]nonanyl)methanol.

Molecular Properties

Compound Name(2-amino-3-bicyclo[3.3.1]nonanyl)methanol
PubChem CID89331972
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2-amino-3-bicyclo[3.3.1]nonanyl)methanol
SMILESNC1C(CO)CC2CCCC1C2
InChIInChI=1S/C10H19NO/c11-10-8-3-1-2-7(4-8)5-9(10)6-12/h7-10,12H,1-6,11H2
InChIKeyWPRKDNZGAYLWTF-UHFFFAOYSA-N
XLogP1.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-amino-3-bicyclo[3.3.1]nonanyl)methanol?
The IUPAC name of (2-amino-3-bicyclo[3.3.1]nonanyl)methanol (CID 89331972) is (2-amino-3-bicyclo[3.3.1]nonanyl)methanol.
What is the SMILES notation for (2-amino-3-bicyclo[3.3.1]nonanyl)methanol?
The canonical SMILES for (2-amino-3-bicyclo[3.3.1]nonanyl)methanol is NC1C(CO)CC2CCCC1C2.
What is the InChIKey of (2-amino-3-bicyclo[3.3.1]nonanyl)methanol?
The InChIKey is WPRKDNZGAYLWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c11-10-8-3-1-2-7(4-8)5-9(10)6-12/h7-10,12H,1-6,11H2.
What are the key properties of (2-amino-3-bicyclo[3.3.1]nonanyl)methanol?
(2-amino-3-bicyclo[3.3.1]nonanyl)methanol has a molecular weight of 169.27 g/mol, XLogP of 1.13, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-bicyclo[3.3.1]nonanyl)methanol is sourced from PubChem (CID 89331972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).