2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole

C19H19N — CID 144585528

IUPAC2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole
SMILESC/C=C\c1c(C)n(-c2ccccc2C)c2ccccc12
InChIInChI=1S/C19H19N/c1-4-9-16-15(3)20(18-12-7-5-10-14(18)2)19-13-8-6-11-17(16)19/h4-13H,1-3H3/b9-4-
InChIKeySTETZIPBQPYMQM-WTKPLQERSA-N
MW261.37 g/mol
LogP5.28
Rot. Bonds2

About 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole

2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole (PubChem CID 144585528) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole.

Molecular Properties

Compound Name2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole
PubChem CID144585528
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole
SMILESC/C=C\c1c(C)n(-c2ccccc2C)c2ccccc12
InChIInChI=1S/C19H19N/c1-4-9-16-15(3)20(18-12-7-5-10-14(18)2)19-13-8-6-11-17(16)19/h4-13H,1-3H3/b9-4-
InChIKeySTETZIPBQPYMQM-WTKPLQERSA-N
XLogP5.28
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500261.37
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indol-2-yl]methanamine
CID 144568571
1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole
CID 130450233
2-methyl-1-[(3Z)-penta-1,3-dien-2-yl]-3-[(Z)-prop-1-enyl]indole
CID 137447929
8-[3-[2-methyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-22-phenyl-8,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene
CID 145004235
2,4-dimethyl-1-phenyl-3-prop-1-enylindole
CID 123318372
4-carbazol-9-yl-9-(2-methylphenyl)carbazole
CID 174273239
2-ethenyl-1-(5-ethyl-2-methylphenyl)-3-[(Z)-prop-1-enyl]indole
CID 142430269
2-[(Z)-2-(1,2-dimethylindol-3-yl)ethenyl]-3-(2-methylphenyl)quinazolin-4-one
CID 92912509
10-[3-(4-carbazol-9-ylphenyl)-5-[4-[2-methyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]-9,9-dimethylacridine;ethane
CID 142935422
9-(2-methylphenyl)-3-[4-[(E)-2-[4-[9-(2-methylphenyl)carbazol-3-yl]phenyl]ethenyl]phenyl]carbazole
CID 59383702
4-(2-methylphenyl)thieno[3,4-b]indole
CID 132503643
ethane;2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indole
CID 176690298

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole?
The IUPAC name of 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole (CID 144585528) is 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole.
What is the SMILES notation for 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole?
The canonical SMILES for 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole is C/C=C\c1c(C)n(-c2ccccc2C)c2ccccc12.
What is the InChIKey of 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole?
The InChIKey is STETZIPBQPYMQM-WTKPLQERSA-N. The full InChI is InChI=1S/C19H19N/c1-4-9-16-15(3)20(18-12-7-5-10-14(18)2)19-13-8-6-11-17(16)19/h4-13H,1-3H3/b9-4-.
What are the key properties of 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole?
2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole has a molecular weight of 261.37 g/mol, XLogP of 5.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylphenyl)-3-[(Z)-prop-1-enyl]indole is sourced from PubChem (CID 144585528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).