1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine

C25H23N3 — CID 155247618

IUPAC1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine
SMILESCc1ccc(N(c2cn(C)c3ccccc23)c2cn(C)c3ccccc23)cc1
InChIInChI=1S/C25H23N3/c1-18-12-14-19(15-13-18)28(24-16-26(2)22-10-6-4-8-20(22)24)25-17-27(3)23-11-7-5-9-21(23)25/h4-17H,1-3H3
InChIKeyPXOJYMJXNQGTBB-UHFFFAOYSA-N
MW365.48 g/mol
LogP6.45
Rot. Bonds3

About 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine

1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine (PubChem CID 155247618) has the molecular formula C25H23N3 and a molecular weight of 365.48 g/mol. Its IUPAC name is 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine.

Molecular Properties

Compound Name1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine
PubChem CID155247618
Molecular FormulaC25H23N3
Molecular Weight365.48 g/mol
Exact Mass365.19
IUPAC Name1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine
SMILESCc1ccc(N(c2cn(C)c3ccccc23)c2cn(C)c3ccccc23)cc1
InChIInChI=1S/C25H23N3/c1-18-12-14-19(15-13-18)28(24-16-26(2)22-10-6-4-8-20(22)24)25-17-27(3)23-11-7-5-9-21(23)25/h4-17H,1-3H3
InChIKeyPXOJYMJXNQGTBB-UHFFFAOYSA-N
XLogP6.45
TPSA13.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.48
LogP ≤ 56.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-(4-methylphenyl)indole
CID 58931542
N-[4-(aminomethyl)phenyl]-N,1-dimethylindol-3-amine
CID 117041625
1-methyl-1-(1-methylindol-3-yl)urea
CID 115168227
N-[4-(4-methylphenyl)phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 70891308
2-(1-methylindol-3-yl)-1,1-bis(4-methylphenyl)ethanol
CID 165375490
1-N,5-N-bis[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-N,5-N-bis(4-methylphenyl)naphthalene-1,5-diamine
CID 20754064
2-N-methyl-2-N-(1-methylindol-3-yl)cyclohexane-1,2-diamine
CID 115117895
4-methyl-N-(4-methylphenyl)-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]aniline
CID 70938011
9-N,9-N,20-N,20-N-tetrakis(4-methylphenyl)hexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12,14,16,19,21,23,25-tridecaene-9,20-diamine
CID 59805356
4-[4-(dimethylamino)phenyl]-N,N-dimethylaniline;9-methylcarbazole;4-methyl-N,N-diphenylaniline;1-N,1-N,4-N-trimethyl-4-N-phenylbenzene-1,4-diamine
CID 160843476
ethane;tris(4-methyl-N,N-diphenylaniline)
CID 159159918
N-(4-methylphenyl)-N,9-diphenylcarbazol-3-amine
CID 90181897

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine?
The IUPAC name of 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine (CID 155247618) is 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine.
What is the SMILES notation for 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine?
The canonical SMILES for 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine is Cc1ccc(N(c2cn(C)c3ccccc23)c2cn(C)c3ccccc23)cc1.
What is the InChIKey of 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine?
The InChIKey is PXOJYMJXNQGTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3/c1-18-12-14-19(15-13-18)28(24-16-26(2)22-10-6-4-8-20(22)24)25-17-27(3)23-11-7-5-9-21(23)25/h4-17H,1-3H3.
What are the key properties of 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine?
1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine has a molecular weight of 365.48 g/mol, XLogP of 6.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1-methylindol-3-yl)-N-(4-methylphenyl)indol-3-amine is sourced from PubChem (CID 155247618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).