3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine

C15H22N2 — CID 83948737

IUPAC3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine
SMILESCc1ccc2c(c1)c(C(C)C)cn2CCCN
InChIInChI=1S/C15H22N2/c1-11(2)14-10-17(8-4-7-16)15-6-5-12(3)9-13(14)15/h5-6,9-11H,4,7-8,16H2,1-3H3
InChIKeySPMXYHALJZKIEH-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.42
Rot. Bonds4

About 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine

3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine (PubChem CID 83948737) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine
PubChem CID83948737
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine
SMILESCc1ccc2c(c1)c(C(C)C)cn2CCCN
InChIInChI=1S/C15H22N2/c1-11(2)14-10-17(8-4-7-16)15-6-5-12(3)9-13(14)15/h5-6,9-11H,4,7-8,16H2,1-3H3
InChIKeySPMXYHALJZKIEH-UHFFFAOYSA-N
XLogP3.42
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,6-dimethylcarbazol-9-yl)propan-1-amine
CID 58183726
1-(3-aminopropyl)-5-methyl-3-propan-2-ylindole-6-carboxylic acid
CID 83963567
1-(1-ethyl-5-methylindol-3-yl)ethanamine
CID 117120993
3-(3-ethyl-5-propan-2-ylindol-1-yl)propan-1-amine
CID 83948594
3-(5-bromo-3-propan-2-ylindol-1-yl)propan-1-ol
CID 83946753
1-[1-(3-aminopropyl)-4,6-dimethylindol-3-yl]ethanol
CID 83944872
(2S)-1-(5-methyl-1-propylindol-3-yl)propan-2-amine
CID 41063911
1-[1-(2-aminoethyl)-5-tert-butylindol-3-yl]ethanol
CID 83945111
3-(3,5-diethylindol-1-yl)propan-1-amine
CID 83948751
2-(4-aminobutyl)-6-methylisoquinolin-1-one
CID 82063079
3-[3-(2-aminoethyl)-5-ethylindol-1-yl]propan-1-amine
CID 83948758
2-[5-methyl-3-(3-piperazin-1-ylpropyl)indol-1-yl]ethanamine
CID 83948925

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine?
The IUPAC name of 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine (CID 83948737) is 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine?
The canonical SMILES for 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine is Cc1ccc2c(c1)c(C(C)C)cn2CCCN.
What is the InChIKey of 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine?
The InChIKey is SPMXYHALJZKIEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-11(2)14-10-17(8-4-7-16)15-6-5-12(3)9-13(14)15/h5-6,9-11H,4,7-8,16H2,1-3H3.
What are the key properties of 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine?
3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine has a molecular weight of 230.35 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine is sourced from PubChem (CID 83948737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).