5,7-dimethyl-3-pentan-2-yl-1H-indole

C15H21N — CID 106985627

IUPAC5,7-dimethyl-3-pentan-2-yl-1H-indole
SMILESCCCC(C)c1c[nH]c2c(C)cc(C)cc12
InChIInChI=1S/C15H21N/c1-5-6-11(3)14-9-16-15-12(4)7-10(2)8-13(14)15/h7-9,11,16H,5-6H2,1-4H3
InChIKeyUHZPZBWXERZETE-UHFFFAOYSA-N
MW215.34 g/mol
LogP4.69
Rot. Bonds3

About 5,7-dimethyl-3-pentan-2-yl-1H-indole

5,7-dimethyl-3-pentan-2-yl-1H-indole (PubChem CID 106985627) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 5,7-dimethyl-3-pentan-2-yl-1H-indole.

Molecular Properties

Compound Name5,7-dimethyl-3-pentan-2-yl-1H-indole
PubChem CID106985627
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name5,7-dimethyl-3-pentan-2-yl-1H-indole
SMILESCCCC(C)c1c[nH]c2c(C)cc(C)cc12
InChIInChI=1S/C15H21N/c1-5-6-11(3)14-9-16-15-12(4)7-10(2)8-13(14)15/h7-9,11,16H,5-6H2,1-4H3
InChIKeyUHZPZBWXERZETE-UHFFFAOYSA-N
XLogP4.69
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

5,7-dimethyl-3-(2-methylpentyl)-1H-indole
CID 106985356
7-bromo-3-pentan-2-yl-1H-indole
CID 106985623
2-(5-methoxy-7-methyl-1H-indol-3-yl)propan-1-amine
CID 82493655
2-(7-methoxy-5-methyl-1H-indol-3-yl)propan-1-amine
CID 82493647
3-iodo-5,7-dimethyl-1H-indole
CID 15247557
2-(5,7-dimethyl-1H-indol-3-yl)acetonitrile
CID 82490743
5-tert-butyl-3-pentan-2-yl-1H-indole
CID 106985614
1-(5,7-dimethyl-1H-indol-3-yl)-N-methylmethanamine
CID 82490831
3-(5,7-dimethyl-1H-indol-3-yl)-N-propan-2-ylpropan-1-amine
CID 96674980
2-(5,7-dimethyl-1H-indol-3-yl)propan-2-amine
CID 82397045
ethane;2-methylpropane-2-thiol;1,3,5-trimethyl-2-pentan-2-ylbenzene;hydrate
CID 142531600
4-ethyl-1-methyl-2-[(2R)-pentan-2-yl]benzene
CID 144520525

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-3-pentan-2-yl-1H-indole?
The IUPAC name of 5,7-dimethyl-3-pentan-2-yl-1H-indole (CID 106985627) is 5,7-dimethyl-3-pentan-2-yl-1H-indole.
What is the SMILES notation for 5,7-dimethyl-3-pentan-2-yl-1H-indole?
The canonical SMILES for 5,7-dimethyl-3-pentan-2-yl-1H-indole is CCCC(C)c1c[nH]c2c(C)cc(C)cc12.
What is the InChIKey of 5,7-dimethyl-3-pentan-2-yl-1H-indole?
The InChIKey is UHZPZBWXERZETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-5-6-11(3)14-9-16-15-12(4)7-10(2)8-13(14)15/h7-9,11,16H,5-6H2,1-4H3.
What are the key properties of 5,7-dimethyl-3-pentan-2-yl-1H-indole?
5,7-dimethyl-3-pentan-2-yl-1H-indole has a molecular weight of 215.34 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-3-pentan-2-yl-1H-indole is sourced from PubChem (CID 106985627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).