3-methyl-8-phenyl-9H-pyrido[2,3-b]indole

C18H14N2 — CID 58028081

IUPAC3-methyl-8-phenyl-9H-pyrido[2,3-b]indole
SMILESCc1cnc2[nH]c3c(-c4ccccc4)cccc3c2c1
InChIInChI=1S/C18H14N2/c1-12-10-16-15-9-5-8-14(13-6-3-2-4-7-13)17(15)20-18(16)19-11-12/h2-11H,1H3,(H,19,20)
InChIKeyHMHZSXVUFFUFCP-UHFFFAOYSA-N
MW258.32 g/mol
LogP4.69
Rot. Bonds1

About 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole

3-methyl-8-phenyl-9H-pyrido[2,3-b]indole (PubChem CID 58028081) has the molecular formula C18H14N2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole.

Molecular Properties

Compound Name3-methyl-8-phenyl-9H-pyrido[2,3-b]indole
PubChem CID58028081
Molecular FormulaC18H14N2
Molecular Weight258.32 g/mol
Exact Mass258.12
IUPAC Name3-methyl-8-phenyl-9H-pyrido[2,3-b]indole
SMILESCc1cnc2[nH]c3c(-c4ccccc4)cccc3c2c1
InChIInChI=1S/C18H14N2/c1-12-10-16-15-9-5-8-14(13-6-3-2-4-7-13)17(15)20-18(16)19-11-12/h2-11H,1H3,(H,19,20)
InChIKeyHMHZSXVUFFUFCP-UHFFFAOYSA-N
XLogP4.69
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole?
The IUPAC name of 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole (CID 58028081) is 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole.
What is the SMILES notation for 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole?
The canonical SMILES for 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole is Cc1cnc2[nH]c3c(-c4ccccc4)cccc3c2c1.
What is the InChIKey of 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole?
The InChIKey is HMHZSXVUFFUFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2/c1-12-10-16-15-9-5-8-14(13-6-3-2-4-7-13)17(15)20-18(16)19-11-12/h2-11H,1H3,(H,19,20).
What are the key properties of 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole?
3-methyl-8-phenyl-9H-pyrido[2,3-b]indole has a molecular weight of 258.32 g/mol, XLogP of 4.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-8-phenyl-9H-pyrido[2,3-b]indole is sourced from PubChem (CID 58028081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).