4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol

C9H15NO — CID 130174273

IUPAC4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol
SMILESCN1CC2CC3CC2C1C3O
InChIInChI=1S/C9H15NO/c1-10-4-6-2-5-3-7(6)8(10)9(5)11/h5-9,11H,2-4H2,1H3
InChIKeyHNRJBKLBKOUWBK-UHFFFAOYSA-N
MW153.22 g/mol
LogP0.32
Rot. Bonds

About 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol

4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol (PubChem CID 130174273) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol.

Molecular Properties

Compound Name4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol
PubChem CID130174273
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol
SMILESCN1CC2CC3CC2C1C3O
InChIInChI=1S/C9H15NO/c1-10-4-6-2-5-3-7(6)8(10)9(5)11/h5-9,11H,2-4H2,1H3
InChIKeyHNRJBKLBKOUWBK-UHFFFAOYSA-N
XLogP0.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
The IUPAC name of 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol (CID 130174273) is 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol.
What is the SMILES notation for 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
The canonical SMILES for 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol is CN1CC2CC3CC2C1C3O.
What is the InChIKey of 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
The InChIKey is HNRJBKLBKOUWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-10-4-6-2-5-3-7(6)8(10)9(5)11/h5-9,11H,2-4H2,1H3.
What are the key properties of 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol has a molecular weight of 153.22 g/mol, XLogP of 0.32, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol is sourced from PubChem (CID 130174273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).