1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine

C24H24N4 — CID 70234390

IUPAC1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1cn(-c2cn(C)cc2-c2c[nH]c3ccccc23)c2ccccc12
InChIInChI=1S/C24H24N4/c1-26(2)13-17-14-28(23-11-7-5-8-18(17)23)24-16-27(3)15-21(24)20-12-25-22-10-6-4-9-19(20)22/h4-12,14-16,25H,13H2,1-3H3
InChIKeyQVLGXYAGXIXXRD-UHFFFAOYSA-N
MW368.48 g/mol
LogP5.18
Rot. Bonds4

About 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine

1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine (PubChem CID 70234390) has the molecular formula C24H24N4 and a molecular weight of 368.48 g/mol. Its IUPAC name is 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine
PubChem CID70234390
Molecular FormulaC24H24N4
Molecular Weight368.48 g/mol
Exact Mass368.20
IUPAC Name1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1cn(-c2cn(C)cc2-c2c[nH]c3ccccc23)c2ccccc12
InChIInChI=1S/C24H24N4/c1-26(2)13-17-14-28(23-11-7-5-8-18(17)23)24-16-27(3)15-21(24)20-12-25-22-10-6-4-9-19(20)22/h4-12,14-16,25H,13H2,1-3H3
InChIKeyQVLGXYAGXIXXRD-UHFFFAOYSA-N
XLogP5.18
TPSA28.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.48
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3-[(dimethylamino)methyl]indol-1-yl]-4-(1H-indol-3-yl)-1-methylpyrrole-2,5-dione
CID 15132380
1-[2-(1H-indol-3-yl)phenyl]-N,N-dimethylmethanamine
CID 174403598
N-[2-(1H-indol-3-yl)ethyl]-2-[1-(1H-indol-3-yl)indol-3-yl]acetamide
CID 101249218
1-[2-(1H-indol-3-ylsulfanyl)phenyl]-N,N-dimethylmethanamine
CID 11818392
3-[2-(dimethylamino)ethyl]-N-[2-(1H-indol-3-yl)ethyl]-N-methylindol-1-amine
CID 91256139
3,4-bis(1H-indol-3-yl)-1-methylpyrrole-2,5-diol
CID 91429863
3-[1-(2-aminoethyl)-4-(dimethylamino)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione
CID 22409286
7-ethyl-3-(1H-indol-3-yl)-1H-indole
CID 46901494
2-(1H-indol-3-yl)-N-[(1-methylindol-3-yl)methyl]ethanamine;hydrochloride
CID 171155113
3-[1-[2-(dimethylamino)ethyl]-4-fluoroindol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione
CID 22410454
3-(1H-indol-3-yl)-4-(1-methylindol-3-yl)furan-2,5-dione
CID 14855714
3-(1H-indol-3-yl)-1-methyl-4-[1-(2-phenylethyl)indol-3-yl]pyrrole-2,5-dione
CID 148910370

Frequently Asked Questions

What is the IUPAC name of 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine (CID 70234390) is 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine is CN(C)Cc1cn(-c2cn(C)cc2-c2c[nH]c3ccccc23)c2ccccc12.
What is the InChIKey of 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine?
The InChIKey is QVLGXYAGXIXXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4/c1-26(2)13-17-14-28(23-11-7-5-8-18(17)23)24-16-27(3)15-21(24)20-12-25-22-10-6-4-9-19(20)22/h4-12,14-16,25H,13H2,1-3H3.
What are the key properties of 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine?
1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine has a molecular weight of 368.48 g/mol, XLogP of 5.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indol-3-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 70234390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).