1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine

C14H20N2 — CID 84622419

IUPAC1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine
SMILESCC(C)c1ccc2c(c1)cc(C(C)N)n2C
InChIInChI=1S/C14H20N2/c1-9(2)11-5-6-13-12(7-11)8-14(10(3)15)16(13)4/h5-10H,15H2,1-4H3
InChIKeyJHVUYVFIJIGKIR-UHFFFAOYSA-N
MW216.33 g/mol
LogP3.32
Rot. Bonds2

About 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine

1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine (PubChem CID 84622419) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine
PubChem CID84622419
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine
SMILESCC(C)c1ccc2c(c1)cc(C(C)N)n2C
InChIInChI=1S/C14H20N2/c1-9(2)11-5-6-13-12(7-11)8-14(10(3)15)16(13)4/h5-10H,15H2,1-4H3
InChIKeyJHVUYVFIJIGKIR-UHFFFAOYSA-N
XLogP3.32
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-aminopropyl)-1-methyl-6-propan-2-ylquinolin-2-one
CID 84637230
2-(1-methyl-2-oxo-6-propan-2-ylquinolin-3-yl)acetonitrile
CID 84629708
1-[1,5-di(propan-2-yl)benzimidazol-2-yl]ethanamine
CID 82333985
1-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)ethanamine
CID 82493456
1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one
CID 59333227
2,6-di(propan-2-yl)naphthalene;ethane
CID 142320223
1-(3-propan-2-ylphenyl)ethanamine
CID 63886929
1-ethyl-2-methyl-5-propan-2-ylindole
CID 155701279
3-(1-methyl-5-propan-2-ylbenzimidazol-2-yl)propan-1-amine
CID 82333928
2,9-di(propan-2-yl)pentacene
CID 153380534
2-tert-butyl-1-methyl-5-propan-2-ylbenzimidazole
CID 83450237
2-(difluoromethyl)-1-methyl-5-propan-2-ylbenzimidazole
CID 176703273

Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine?
The IUPAC name of 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine (CID 84622419) is 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine.
What is the SMILES notation for 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine?
The canonical SMILES for 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine is CC(C)c1ccc2c(c1)cc(C(C)N)n2C.
What is the InChIKey of 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine?
The InChIKey is JHVUYVFIJIGKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-9(2)11-5-6-13-12(7-11)8-14(10(3)15)16(13)4/h5-10H,15H2,1-4H3.
What are the key properties of 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine?
1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine has a molecular weight of 216.33 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-5-propan-2-ylindol-2-yl)ethanamine is sourced from PubChem (CID 84622419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).