7-azatricyclo[4.3.1.03,7]decan-9-one

C9H13NO — CID 15639106

IUPAC7-azatricyclo[4.3.1.03,7]decan-9-one
SMILESO=C1CN2C3CCC2CC1C3
InChIInChI=1S/C9H13NO/c11-9-5-10-7-1-2-8(10)4-6(9)3-7/h6-8H,1-5H2
InChIKeyUWOZSUJRZUMVQS-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.81
Rot. Bonds

About 7-azatricyclo[4.3.1.03,7]decan-9-one

7-azatricyclo[4.3.1.03,7]decan-9-one (PubChem CID 15639106) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 7-azatricyclo[4.3.1.03,7]decan-9-one.

Molecular Properties

Compound Name7-azatricyclo[4.3.1.03,7]decan-9-one
PubChem CID15639106
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name7-azatricyclo[4.3.1.03,7]decan-9-one
SMILESO=C1CN2C3CCC2CC1C3
InChIInChI=1S/C9H13NO/c11-9-5-10-7-1-2-8(10)4-6(9)3-7/h6-8H,1-5H2
InChIKeyUWOZSUJRZUMVQS-UHFFFAOYSA-N
XLogP0.81
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-azatricyclo[4.3.1.03,7]decan-9-one?
The IUPAC name of 7-azatricyclo[4.3.1.03,7]decan-9-one (CID 15639106) is 7-azatricyclo[4.3.1.03,7]decan-9-one.
What is the SMILES notation for 7-azatricyclo[4.3.1.03,7]decan-9-one?
The canonical SMILES for 7-azatricyclo[4.3.1.03,7]decan-9-one is O=C1CN2C3CCC2CC1C3.
What is the InChIKey of 7-azatricyclo[4.3.1.03,7]decan-9-one?
The InChIKey is UWOZSUJRZUMVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c11-9-5-10-7-1-2-8(10)4-6(9)3-7/h6-8H,1-5H2.
What are the key properties of 7-azatricyclo[4.3.1.03,7]decan-9-one?
7-azatricyclo[4.3.1.03,7]decan-9-one has a molecular weight of 151.21 g/mol, XLogP of 0.81, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-azatricyclo[4.3.1.03,7]decan-9-one is sourced from PubChem (CID 15639106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).