9-methyl-N,N-diphenylcarbazol-1-amine

C25H20N2 — CID 126631131

IUPAC9-methyl-N,N-diphenylcarbazol-1-amine
SMILESCn1c2ccccc2c2cccc(N(c3ccccc3)c3ccccc3)c21
InChIInChI=1S/C25H20N2/c1-26-23-17-9-8-15-21(23)22-16-10-18-24(25(22)26)27(19-11-4-2-5-12-19)20-13-6-3-7-14-20/h2-18H,1H3
InChIKeyQIGUADUVSUQTCS-UHFFFAOYSA-N
MW348.45 g/mol
LogP6.80
Rot. Bonds3

About 9-methyl-N,N-diphenylcarbazol-1-amine

9-methyl-N,N-diphenylcarbazol-1-amine (PubChem CID 126631131) has the molecular formula C25H20N2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 9-methyl-N,N-diphenylcarbazol-1-amine.

Molecular Properties

Compound Name9-methyl-N,N-diphenylcarbazol-1-amine
PubChem CID126631131
Molecular FormulaC25H20N2
Molecular Weight348.45 g/mol
Exact Mass348.16
IUPAC Name9-methyl-N,N-diphenylcarbazol-1-amine
SMILESCn1c2ccccc2c2cccc(N(c3ccccc3)c3ccccc3)c21
InChIInChI=1S/C25H20N2/c1-26-23-17-9-8-15-21(23)22-16-10-18-24(25(22)26)27(19-11-4-2-5-12-19)20-13-6-3-7-14-20/h2-18H,1H3
InChIKeyQIGUADUVSUQTCS-UHFFFAOYSA-N
XLogP6.80
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-N,N-diphenylcarbazol-1-amine?
The IUPAC name of 9-methyl-N,N-diphenylcarbazol-1-amine (CID 126631131) is 9-methyl-N,N-diphenylcarbazol-1-amine.
What is the SMILES notation for 9-methyl-N,N-diphenylcarbazol-1-amine?
The canonical SMILES for 9-methyl-N,N-diphenylcarbazol-1-amine is Cn1c2ccccc2c2cccc(N(c3ccccc3)c3ccccc3)c21.
What is the InChIKey of 9-methyl-N,N-diphenylcarbazol-1-amine?
The InChIKey is QIGUADUVSUQTCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2/c1-26-23-17-9-8-15-21(23)22-16-10-18-24(25(22)26)27(19-11-4-2-5-12-19)20-13-6-3-7-14-20/h2-18H,1H3.
What are the key properties of 9-methyl-N,N-diphenylcarbazol-1-amine?
9-methyl-N,N-diphenylcarbazol-1-amine has a molecular weight of 348.45 g/mol, XLogP of 6.80, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-N,N-diphenylcarbazol-1-amine is sourced from PubChem (CID 126631131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).