N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine

C31H24N2 — CID 130260572

IUPACN-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine
SMILESCN(c1ccccc1)c1cccc2c1N(c1ccccc1)c1ccccc1-c1ccccc1-2
InChIInChI=1S/C31H24N2/c1-32(23-13-4-2-5-14-23)30-22-12-20-28-26-18-9-8-17-25(26)27-19-10-11-21-29(27)33(31(28)30)24-15-6-3-7-16-24/h2-22H,1H3
InChIKeyWBVCFRQENFIWKA-UHFFFAOYSA-N
MW424.55 g/mol
LogP8.57
Rot. Bonds3

About N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine

N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine (PubChem CID 130260572) has the molecular formula C31H24N2 and a molecular weight of 424.55 g/mol. Its IUPAC name is N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine.

Molecular Properties

Compound NameN-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine
PubChem CID130260572
Molecular FormulaC31H24N2
Molecular Weight424.55 g/mol
Exact Mass424.19
IUPAC NameN-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine
SMILESCN(c1ccccc1)c1cccc2c1N(c1ccccc1)c1ccccc1-c1ccccc1-2
InChIInChI=1S/C31H24N2/c1-32(23-13-4-2-5-14-23)30-22-12-20-28-26-18-9-8-17-25(26)27-19-10-11-21-29(27)33(31(28)30)24-15-6-3-7-16-24/h2-22H,1H3
InChIKeyWBVCFRQENFIWKA-UHFFFAOYSA-N
XLogP8.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.55
LogP ≤ 58.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine 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

N,14-diphenyl-N-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine
CID 130264530
14-phenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene
CID 59838794
N-(9,9-dimethylfluoren-2-yl)-N-methyl-14-phenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-amine;14-methyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene;N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine;10-methyl-14-phenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene;N-methyl-14-phenyl-N-(2-phenylphenyl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-amine;N-methyl-14-phenyl-N-(4-phenylphenyl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-amine
CID 157332322
N-methyl-2-[2-(N-methylanilino)phenyl]-N-phenylaniline
CID 132560477
N,4-diphenyl-N-[4-[3-(14-phenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl)phenyl]phenyl]aniline
CID 129062206
14-phenyl-N-(3-phenylphenyl)-N-spiro[fluorene-9,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-2-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine
CID 130260450
N,2-dimethyl-N,3-diphenylaniline
CID 54080390
2-(N-methylanilino)-7-phenylcyclohepta-2,4,6-trien-1-one
CID 15090544
N,14-diphenyl-N-spiro[9-oxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene-14,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine
CID 130463628
N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 134309245
1,4-bis(N-methylanilino)anthracene-9,10-dione
CID 101406322
14-phenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-amine
CID 129062188

Frequently Asked Questions

What is the IUPAC name of N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine?
The IUPAC name of N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine (CID 130260572) is N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine.
What is the SMILES notation for N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine?
The canonical SMILES for N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine is CN(c1ccccc1)c1cccc2c1N(c1ccccc1)c1ccccc1-c1ccccc1-2.
What is the InChIKey of N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine?
The InChIKey is WBVCFRQENFIWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N2/c1-32(23-13-4-2-5-14-23)30-22-12-20-28-26-18-9-8-17-25(26)27-19-10-11-21-29(27)33(31(28)30)24-15-6-3-7-16-24/h2-22H,1H3.
What are the key properties of N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine?
N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine has a molecular weight of 424.55 g/mol, XLogP of 8.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N,14-diphenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine is sourced from PubChem (CID 130260572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).