2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole

C14H14N2 — CID 175789858

IUPAC2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole
SMILESCc1[nH]c2ccccc2c1-c1ccn(C)c1
InChIInChI=1S/C14H14N2/c1-10-14(11-7-8-16(2)9-11)12-5-3-4-6-13(12)15-10/h3-9,15H,1-2H3
InChIKeyYABRNHIHWCDWRO-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.48
Rot. Bonds1

About 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole

2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole (PubChem CID 175789858) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole.

Molecular Properties

Compound Name2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole
PubChem CID175789858
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole
SMILESCc1[nH]c2ccccc2c1-c1ccn(C)c1
InChIInChI=1S/C14H14N2/c1-10-14(11-7-8-16(2)9-11)12-5-3-4-6-13(12)15-10/h3-9,15H,1-2H3
InChIKeyYABRNHIHWCDWRO-UHFFFAOYSA-N
XLogP3.48
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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3-bromo-4-(2-methyl-1H-indol-3-yl)pyrrole-2,5-dione
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4-(4-methoxyphenyl)-3,5,7-trimethyl-11-(2-methyl-1H-indol-3-yl)-4,8,9-triazatricyclo[7.3.0.02,6]dodeca-1(12),2,5,7,10-pentaene
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2-(3-methyl-1H-indol-2-yl)-3-phenyl-1H-indole
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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole?
The IUPAC name of 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole (CID 175789858) is 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole.
What is the SMILES notation for 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole?
The canonical SMILES for 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole is Cc1[nH]c2ccccc2c1-c1ccn(C)c1.
What is the InChIKey of 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole?
The InChIKey is YABRNHIHWCDWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-10-14(11-7-8-16(2)9-11)12-5-3-4-6-13(12)15-10/h3-9,15H,1-2H3.
What are the key properties of 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole?
2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole has a molecular weight of 210.28 g/mol, XLogP of 3.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1-methylpyrrol-3-yl)-1H-indole is sourced from PubChem (CID 175789858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).