N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine

C30H24N2 — CID 143570314

IUPACN-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine
SMILESCN(c1ccc(-n2c3c(c4ccccc42)C=CC2CC32)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C30H24N2/c1-31(25-12-10-20-6-2-3-7-21(20)18-25)23-13-15-24(16-14-23)32-29-9-5-4-8-26(29)27-17-11-22-19-28(22)30(27)32/h2-18,22,28H,19H2,1H3
InChIKeyNSASVYWGIBTPGB-UHFFFAOYSA-N
MW412.54 g/mol
LogP7.68
Rot. Bonds3

About N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine

N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine (PubChem CID 143570314) has the molecular formula C30H24N2 and a molecular weight of 412.54 g/mol. Its IUPAC name is N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine
PubChem CID143570314
Molecular FormulaC30H24N2
Molecular Weight412.54 g/mol
Exact Mass412.19
IUPAC NameN-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine
SMILESCN(c1ccc(-n2c3c(c4ccccc42)C=CC2CC32)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C30H24N2/c1-31(25-12-10-20-6-2-3-7-21(20)18-25)23-13-15-24(16-14-23)32-29-9-5-4-8-26(29)27-17-11-22-19-28(22)30(27)32/h2-18,22,28H,19H2,1H3
InChIKeyNSASVYWGIBTPGB-UHFFFAOYSA-N
XLogP7.68
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.54
LogP ≤ 57.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine with MolForge

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Related Compounds

N-(3-carbazol-9-ylphenyl)-N-methylnaphthalen-2-amine
CID 58903517
N-methyl-9-naphthalen-2-yl-N-phenylcarbazol-4-amine
CID 126631465
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(N-methyl-2-phenylanilino)phenyl]phenyl]naphthalen-2-amine
CID 137467140
(2R)-1,2-dimethyl-9-phenyl-1,2-dihydrocarbazole
CID 70929960
4-benzo[a]carbazol-11-yl-N-methyl-N-phenylaniline;N-methyl-N,11-diphenylbenzo[a]carbazol-8-amine;N-methyl-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-8-amine
CID 162064475
N-methyl-N-(4-methylphenyl)-9-phenylcarbazol-3-amine
CID 58903567
N-methyl-4-[4-(5-naphthalen-2-ylbenzo[b]carbazol-2-yl)phenyl]-N-phenylaniline
CID 126632612
N-(4-carbazol-9-ylphenyl)-N,3-dimethyl-4-(2-methylphenyl)aniline
CID 71107984
N-naphthalen-2-yl-N-(6-pentacyclo[10.7.1.02,7.08,20.014,19]icosa-1(20),2(7),3,5,8,10,12,14,16,18-decaenyl)-9-phenyl-1,2-dihydrocarbazol-2-amine
CID 167281738
1-N-naphthalen-2-yl-3-N-[3-(N-naphthalen-2-ylanilino)phenyl]-1-N-phenyl-3-N-(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 177275896
ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 143983755
3-carbazol-9-yl-N-methyl-N-phenylaniline
CID 59211086

Frequently Asked Questions

What is the IUPAC name of N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine?
The IUPAC name of N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine (CID 143570314) is N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine.
What is the SMILES notation for N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine?
The canonical SMILES for N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine is CN(c1ccc(-n2c3c(c4ccccc42)C=CC2CC32)cc1)c1ccc2ccccc2c1.
What is the InChIKey of N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine?
The InChIKey is NSASVYWGIBTPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N2/c1-31(25-12-10-20-6-2-3-7-21(20)18-25)23-13-15-24(16-14-23)32-29-9-5-4-8-26(29)27-17-11-22-19-28(22)30(27)32/h2-18,22,28H,19H2,1H3.
What are the key properties of N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine?
N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine has a molecular weight of 412.54 g/mol, XLogP of 7.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(8-azatetracyclo[7.5.0.02,7.010,12]tetradeca-1(9),2,4,6,13-pentaen-8-yl)phenyl]-N-methylnaphthalen-2-amine is sourced from PubChem (CID 143570314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).