(6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol

C11H19NO — CID 6621013

IUPAC(6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol
SMILESCC12CNC3(CO)CC1CCC32C
InChIInChI=1S/C11H19NO/c1-9-6-12-11(7-13)5-8(9)3-4-10(9,11)2/h8,12-13H,3-7H2,1-2H3
InChIKeyZMSXCDRTNNVSSX-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.15
Rot. Bonds1

About (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol

(6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol (PubChem CID 6621013) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol.

Molecular Properties

Compound Name(6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol
PubChem CID6621013
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name(6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol
SMILESCC12CNC3(CO)CC1CCC32C
InChIInChI=1S/C11H19NO/c1-9-6-12-11(7-13)5-8(9)3-4-10(9,11)2/h8,12-13H,3-7H2,1-2H3
InChIKeyZMSXCDRTNNVSSX-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol?
The IUPAC name of (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol (CID 6621013) is (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol.
What is the SMILES notation for (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol?
The canonical SMILES for (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol is CC12CNC3(CO)CC1CCC32C.
What is the InChIKey of (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol?
The InChIKey is ZMSXCDRTNNVSSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-9-6-12-11(7-13)5-8(9)3-4-10(9,11)2/h8,12-13H,3-7H2,1-2H3.
What are the key properties of (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol?
(6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol has a molecular weight of 181.28 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,7-dimethyl-4-azatricyclo[4.3.0.03,7]nonan-3-yl)methanol is sourced from PubChem (CID 6621013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).