9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine

C23H20N2 — CID 149003548

IUPAC9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine
SMILESCn1c2c(c3cc(Nc4ccc5ccccc5c4)ccc31)CCC=C2
InChIInChI=1S/C23H20N2/c1-25-22-9-5-4-8-20(22)21-15-19(12-13-23(21)25)24-18-11-10-16-6-2-3-7-17(16)14-18/h2-3,5-7,9-15,24H,4,8H2,1H3
InChIKeyQADBUFFLYBHFGI-UHFFFAOYSA-N
MW324.43 g/mol
LogP6.03
Rot. Bonds2

About 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine

9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine (PubChem CID 149003548) has the molecular formula C23H20N2 and a molecular weight of 324.43 g/mol. Its IUPAC name is 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine.

Molecular Properties

Compound Name9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine
PubChem CID149003548
Molecular FormulaC23H20N2
Molecular Weight324.43 g/mol
Exact Mass324.16
IUPAC Name9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine
SMILESCn1c2c(c3cc(Nc4ccc5ccccc5c4)ccc31)CCC=C2
InChIInChI=1S/C23H20N2/c1-25-22-9-5-4-8-20(22)21-15-19(12-13-23(21)25)24-18-11-10-16-6-2-3-7-17(16)14-18/h2-3,5-7,9-15,24H,4,8H2,1H3
InChIKeyQADBUFFLYBHFGI-UHFFFAOYSA-N
XLogP6.03
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.43
LogP ≤ 56.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6,9-dimethyl-3,4-dihydrocarbazole
CID 134550715
N,9-dimethyl-N-(4-phenylphenyl)-5,6-dihydrocarbazol-3-amine
CID 149474002
N-(7,8-dihydronaphthalen-2-yl)naphthalen-2-amine
CID 172758843
11,12-dimethyl-7,8-dihydroindolo[2,3-a]carbazole
CID 163716451
1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
CID 7142
ethane;N-naphthalen-2-yl-9-phenylcarbazol-3-amine
CID 144861482
1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine
CID 82536270
6-tert-butyl-9-phenyl-3,4-dihydrocarbazole
CID 134351479
N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine
CID 146594518
N-pentacen-2-ylpentacen-2-amine
CID 91227915
N-[4-[3-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]-4-phenylaniline
CID 146356785
2-(3-naphthalen-2-ylphenyl)naphthalene;N-(7,8,9,10-tetrahydrotriphenylen-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 145204079

Frequently Asked Questions

What is the IUPAC name of 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine?
The IUPAC name of 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine (CID 149003548) is 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine.
What is the SMILES notation for 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine?
The canonical SMILES for 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine is Cn1c2c(c3cc(Nc4ccc5ccccc5c4)ccc31)CCC=C2.
What is the InChIKey of 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine?
The InChIKey is QADBUFFLYBHFGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2/c1-25-22-9-5-4-8-20(22)21-15-19(12-13-23(21)25)24-18-11-10-16-6-2-3-7-17(16)14-18/h2-3,5-7,9-15,24H,4,8H2,1H3.
What are the key properties of 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine?
9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine has a molecular weight of 324.43 g/mol, XLogP of 6.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-N-naphthalen-2-yl-5,6-dihydrocarbazol-3-amine is sourced from PubChem (CID 149003548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).