N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine

C27H19N3 — CID 143613415

IUPACN-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine
SMILESc1ccc(-n2c3ccncc3c3cc(Nc4ccc5ccccc5c4)ccc32)cc1
InChIInChI=1S/C27H19N3/c1-2-8-23(9-3-1)30-26-13-12-22(17-24(26)25-18-28-15-14-27(25)30)29-21-11-10-19-6-4-5-7-20(19)16-21/h1-18,29H
InChIKeySYPXCMNZVDAQES-UHFFFAOYSA-N
MW385.47 g/mol
LogP7.08
Rot. Bonds3

About N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine

N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine (PubChem CID 143613415) has the molecular formula C27H19N3 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine
PubChem CID143613415
Molecular FormulaC27H19N3
Molecular Weight385.47 g/mol
Exact Mass385.16
IUPAC NameN-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine
SMILESc1ccc(-n2c3ccncc3c3cc(Nc4ccc5ccccc5c4)ccc32)cc1
InChIInChI=1S/C27H19N3/c1-2-8-23(9-3-1)30-26-13-12-22(17-24(26)25-18-28-15-14-27(25)30)29-21-11-10-19-6-4-5-7-20(19)16-21/h1-18,29H
InChIKeySYPXCMNZVDAQES-UHFFFAOYSA-N
XLogP7.08
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.47
LogP ≤ 57.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-naphthalen-2-yl-9-phenylcarbazol-3-amine
CID 144861482
8-carbazol-9-yl-5-phenylpyrido[4,3-b]indole
CID 149133438
8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-(4-phenylphenyl)pyrido[4,3-b]indole
CID 121277490
8-[6-(3-tert-butyl-10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]-5-phenylpyrido[4,3-b]indole
CID 88886632
methanol;8-[4-(10-naphthalen-2-ylanthracen-9-yl)naphthalen-1-yl]-5-phenylpyrido[4,3-b]indole
CID 159089156
8-[6-(3-methyl-10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]-5-phenylpyrido[4,3-b]indole
CID 146427804
4-(4-naphthalen-2-ylphenyl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]aniline
CID 59288178
N-(4-naphthalen-2-ylphenyl)-4-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59288183
8-[6-(9,10-dinaphthalen-2-ylanthracen-2-yl)pyrimidin-4-yl]-5-phenylpyrido[4,3-b]indole
CID 118968803
8-(4-bromophenyl)-5-phenylpyrido[4,3-b]indole
CID 70663911
6-methyl-N,9-diphenylcarbazol-3-amine
CID 58807692
9-phenyl-N-[4-[4-[(9-phenylcarbazol-3-yl)amino]phenyl]phenyl]carbazol-3-amine
CID 118227253

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine?
The IUPAC name of N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine (CID 143613415) is N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine.
What is the SMILES notation for N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine?
The canonical SMILES for N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine is c1ccc(-n2c3ccncc3c3cc(Nc4ccc5ccccc5c4)ccc32)cc1.
What is the InChIKey of N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine?
The InChIKey is SYPXCMNZVDAQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H19N3/c1-2-8-23(9-3-1)30-26-13-12-22(17-24(26)25-18-28-15-14-27(25)30)29-21-11-10-19-6-4-5-7-20(19)16-21/h1-18,29H.
What are the key properties of N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine?
N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine has a molecular weight of 385.47 g/mol, XLogP of 7.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-5-phenylpyrido[4,3-b]indol-8-amine is sourced from PubChem (CID 143613415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).