15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene

C18H25N — CID 67911042

IUPAC15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene
SMILESCCCN1CC2=C3CCCCC31C1CCC=CC1=C2
InChIInChI=1S/C18H25N/c1-2-11-19-13-15-12-14-7-3-4-8-16(14)18(19)10-6-5-9-17(15)18/h3,7,12,16H,2,4-6,8-11,13H2,1H3
InChIKeyJCLFPDCKUTZPDG-UHFFFAOYSA-N
MW255.40 g/mol
LogP4.23
Rot. Bonds2

About 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene

15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene (PubChem CID 67911042) has the molecular formula C18H25N and a molecular weight of 255.40 g/mol. Its IUPAC name is 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene.

Molecular Properties

Compound Name15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene
PubChem CID67911042
Molecular FormulaC18H25N
Molecular Weight255.40 g/mol
Exact Mass255.20
IUPAC Name15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene
SMILESCCCN1CC2=C3CCCCC31C1CCC=CC1=C2
InChIInChI=1S/C18H25N/c1-2-11-19-13-15-12-14-7-3-4-8-16(14)18(19)10-6-5-9-17(15)18/h3,7,12,16H,2,4-6,8-11,13H2,1H3
InChIKeyJCLFPDCKUTZPDG-UHFFFAOYSA-N
XLogP4.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene 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 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene?
The IUPAC name of 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene (CID 67911042) is 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene.
What is the SMILES notation for 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene?
The canonical SMILES for 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene is CCCN1CC2=C3CCCCC31C1CCC=CC1=C2.
What is the InChIKey of 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene?
The InChIKey is JCLFPDCKUTZPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N/c1-2-11-19-13-15-12-14-7-3-4-8-16(14)18(19)10-6-5-9-17(15)18/h3,7,12,16H,2,4-6,8-11,13H2,1H3.
What are the key properties of 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene?
15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene has a molecular weight of 255.40 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 15-propyl-15-azatetracyclo[7.5.2.01,10.02,7]hexadeca-5,7,9-triene is sourced from PubChem (CID 67911042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).