3-methyl-1,5-di(propan-2-yl)indole

C15H21N — CID 176559687

IUPAC3-methyl-1,5-di(propan-2-yl)indole
SMILESCc1cn(C(C)C)c2ccc(C(C)C)cc12
InChIInChI=1S/C15H21N/c1-10(2)13-6-7-15-14(8-13)12(5)9-16(15)11(3)4/h6-11H,1-5H3
InChIKeySHRLAYCXGGJSGW-UHFFFAOYSA-N
MW215.34 g/mol
LogP4.65
Rot. Bonds2

About 3-methyl-1,5-di(propan-2-yl)indole

3-methyl-1,5-di(propan-2-yl)indole (PubChem CID 176559687) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 3-methyl-1,5-di(propan-2-yl)indole.

Molecular Properties

Compound Name3-methyl-1,5-di(propan-2-yl)indole
PubChem CID176559687
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name3-methyl-1,5-di(propan-2-yl)indole
SMILESCc1cn(C(C)C)c2ccc(C(C)C)cc12
InChIInChI=1S/C15H21N/c1-10(2)13-6-7-15-14(8-13)12(5)9-16(15)11(3)4/h6-11H,1-5H3
InChIKeySHRLAYCXGGJSGW-UHFFFAOYSA-N
XLogP4.65
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-dimethoxy-4-propan-2-ylbenzene;1,3-dimethyl-5-propan-2-ylindole
CID 163892764
(1-methyl-5-propan-2-ylindol-3-yl)methanamine
CID 82491626
3-methyl-1-(4-propan-2-ylphenyl)indol-5-ol;hydrochloride
CID 174345807
1-(1,2-dimethyl-5-propan-2-ylindol-3-yl)ethanone
CID 82494938
5,20-bis(2-methylphenyl)-13,28-di(propan-2-yl)-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1,3(8),4,6,10(15),11,13,16(32),17(31),18(23),19,21,25(30),26,28-pentadecaene
CID 154591236
5,20-di(propan-2-yl)-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1(31),2(32),3(8),4,6,10,12,14,16,18(23),19,21,25,27,29-pentadecaene
CID 154591260
3,5-dichloro-1-propan-2-ylindole
CID 166553086
1,2-dimethyl-4-propan-2-ylbenzene;ethane
CID 142019921
N-methyl-1-(3-methyl-1-propan-2-ylindol-6-yl)propan-2-amine
CID 117205038
4-[1-(3,5-dimethylindol-1-yl)-2,2-dimethylpropyl]-N-hydroxybenzamide
CID 87383896
1,3-dimethyl-5-propan-2-ylindazole;3-iodo-1-methyl-5-propan-2-ylindazole
CID 158986215
3-methyl-5-propan-2-ylindazole-1-carboxylic acid
CID 90786084

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,5-di(propan-2-yl)indole?
The IUPAC name of 3-methyl-1,5-di(propan-2-yl)indole (CID 176559687) is 3-methyl-1,5-di(propan-2-yl)indole.
What is the SMILES notation for 3-methyl-1,5-di(propan-2-yl)indole?
The canonical SMILES for 3-methyl-1,5-di(propan-2-yl)indole is Cc1cn(C(C)C)c2ccc(C(C)C)cc12.
What is the InChIKey of 3-methyl-1,5-di(propan-2-yl)indole?
The InChIKey is SHRLAYCXGGJSGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-10(2)13-6-7-15-14(8-13)12(5)9-16(15)11(3)4/h6-11H,1-5H3.
What are the key properties of 3-methyl-1,5-di(propan-2-yl)indole?
3-methyl-1,5-di(propan-2-yl)indole has a molecular weight of 215.34 g/mol, XLogP of 4.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,5-di(propan-2-yl)indole is sourced from PubChem (CID 176559687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).