20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene

C24H17N — CID 163867502

IUPAC20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene
SMILESC1=CC2=c3ccccc3=c3ccccc3=c3cccc/c3=N/C2C=C1
InChIInChI=1S/C24H17N/c1-3-11-19-17(9-1)18-10-2-4-12-20(18)22-14-6-8-16-24(22)25-23-15-7-5-13-21(19)23/h1-16,23H/b18-17?,21-19?,22-20?,25-24-
InChIKeyCMHZXEACNRSJRY-TZHAVKOKSA-N
MW319.41 g/mol
LogP3.54
Rot. Bonds

About 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene

20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene (PubChem CID 163867502) has the molecular formula C24H17N and a molecular weight of 319.41 g/mol. Its IUPAC name is 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene.

Molecular Properties

Compound Name20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene
PubChem CID163867502
Molecular FormulaC24H17N
Molecular Weight319.41 g/mol
Exact Mass319.14
IUPAC Name20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene
SMILESC1=CC2=c3ccccc3=c3ccccc3=c3cccc/c3=N/C2C=C1
InChIInChI=1S/C24H17N/c1-3-11-19-17(9-1)18-10-2-4-12-20(18)22-14-6-8-16-24(22)25-23-15-7-5-13-21(19)23/h1-16,23H/b18-17?,21-19?,22-20?,25-24-
InChIKeyCMHZXEACNRSJRY-TZHAVKOKSA-N
XLogP3.54
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8aH-carbazole
CID 9548747
Tetrabenzo(B,D,H,J)(1,6)diazacyclododecine
CID 91869782
Tetrabenzo[b,f,j,n][1,5,9,13]tetraazacyclohexadecine
CID 171086
2-methyl-2H-indole
CID 58371059
4a,9a-Dihydroacridine
CID 89376300
Tetrabenzo(b,d,H,j)(1,6)-diaza-cyclododecine
CID 5379414
(3Z,11Z,19Z,27Z)-2,10,18,26-tetrazapentacyclo[26.4.0.04,9.012,17.020,25]dotriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31-hexadecaene
CID 11970187
3-methylidene-2-(3-methylidene-8aH-quinolin-2-yl)-8aH-quinoline
CID 91130675
Tetrabenzo[b,f,j,n][1,4,9,12]tetraazacyclohexadecine
CID 129856917
2,3-Dihydrobenzo[g]quinoline
CID 21712583
4,8a-dihydro-1H-carbazole
CID 57177752
2-Azabicyclo[2.2.2]octa-1,4(8),5-triene
CID 57194488

Frequently Asked Questions

What is the IUPAC name of 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene?
The IUPAC name of 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene (CID 163867502) is 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene.
What is the SMILES notation for 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene?
The canonical SMILES for 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene is C1=CC2=c3ccccc3=c3ccccc3=c3cccc/c3=N/C2C=C1.
What is the InChIKey of 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene?
The InChIKey is CMHZXEACNRSJRY-TZHAVKOKSA-N. The full InChI is InChI=1S/C24H17N/c1-3-11-19-17(9-1)18-10-2-4-12-20(18)22-14-6-8-16-24(22)25-23-15-7-5-13-21(19)23/h1-16,23H/b18-17?,21-19?,22-20?,25-24-.
What are the key properties of 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene?
20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene has a molecular weight of 319.41 g/mol, XLogP of 3.54, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1,3,5,7,9,11,13,15,17,19,22,24-dodecaene is sourced from PubChem (CID 163867502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).