1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol

C16H15NO — CID 19848656

IUPAC1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol
SMILESCC12NC(O)(Cc3ccccc31)c1ccccc12
InChIInChI=1S/C16H15NO/c1-15-12-7-3-2-6-11(12)10-16(18,17-15)14-9-5-4-8-13(14)15/h2-9,17-18H,10H2,1H3
InChIKeyQXTJCDWOZBLHNY-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.25
Rot. Bonds

About 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol

1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol (PubChem CID 19848656) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol.

Molecular Properties

Compound Name1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol
PubChem CID19848656
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol
SMILESCC12NC(O)(Cc3ccccc31)c1ccccc12
InChIInChI=1S/C16H15NO/c1-15-12-7-3-2-6-11(12)10-16(18,17-15)14-9-5-4-8-13(14)15/h2-9,17-18H,10H2,1H3
InChIKeyQXTJCDWOZBLHNY-UHFFFAOYSA-N
XLogP2.25
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol 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 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol?
The IUPAC name of 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol (CID 19848656) is 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol.
What is the SMILES notation for 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol?
The canonical SMILES for 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol is CC12NC(O)(Cc3ccccc31)c1ccccc12.
What is the InChIKey of 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol?
The InChIKey is QXTJCDWOZBLHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-15-12-7-3-2-6-11(12)10-16(18,17-15)14-9-5-4-8-13(14)15/h2-9,17-18H,10H2,1H3.
What are the key properties of 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol?
1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol has a molecular weight of 237.30 g/mol, XLogP of 2.25, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-16-azatetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10,12,14-hexaen-9-ol is sourced from PubChem (CID 19848656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).