3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine

C15H22N2 — CID 83948289

IUPAC3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine
SMILESCCc1cn(CCCN)c2cc(C)c(C)cc12
InChIInChI=1S/C15H22N2/c1-4-13-10-17(7-5-6-16)15-9-12(3)11(2)8-14(13)15/h8-10H,4-7,16H2,1-3H3
InChIKeyGCTXXZKMBBFSNC-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.17
Rot. Bonds4

About 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine

3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine (PubChem CID 83948289) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine
PubChem CID83948289
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine
SMILESCCc1cn(CCCN)c2cc(C)c(C)cc12
InChIInChI=1S/C15H22N2/c1-4-13-10-17(7-5-6-16)15-9-12(3)11(2)8-14(13)15/h8-10H,4-7,16H2,1-3H3
InChIKeyGCTXXZKMBBFSNC-UHFFFAOYSA-N
XLogP3.17
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 ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(3-aminopropyl)-5,6-dimethylindol-3-yl]acetic acid
CID 83944371
3-(5,6-diethoxy-3-ethylindol-1-yl)propan-1-amine
CID 83948447
3-(6-chloro-3-ethyl-5-methoxyindol-1-yl)propan-1-amine
CID 83948348
3-(3,5-diethylindol-1-yl)propan-1-amine
CID 83948751
3-(8-ethyl-2,3-dihydro-[1,4]dioxino[2,3-f]indol-6-yl)propan-1-amine
CID 83948422
2-[1-(2-aminoethyl)-5,6-dimethylindol-3-yl]acetic acid
CID 83944375
3-(3-ethyl-5-propan-2-ylindol-1-yl)propan-1-amine
CID 83948594
3-[1-(3-aminopropyl)-5,6-dimethoxyindol-3-yl]propan-1-amine
CID 83948403
2-[1-(3-aminopropyl)-5,6-dimethoxyindol-3-yl]acetic acid
CID 83944609
3-[3-(2-aminoethyl)-5-ethylindol-1-yl]propan-1-amine
CID 83948758
3-(5-ethyl-3-propylindol-1-yl)propan-1-amine
CID 83948753
3-(5,6-dimethyl-1-propylindol-3-yl)propan-1-ol
CID 83944350

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine?
The IUPAC name of 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine (CID 83948289) is 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine?
The canonical SMILES for 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine is CCc1cn(CCCN)c2cc(C)c(C)cc12.
What is the InChIKey of 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine?
The InChIKey is GCTXXZKMBBFSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-4-13-10-17(7-5-6-16)15-9-12(3)11(2)8-14(13)15/h8-10H,4-7,16H2,1-3H3.
What are the key properties of 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine?
3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine has a molecular weight of 230.35 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethyl-5,6-dimethylindol-1-yl)propan-1-amine is sourced from PubChem (CID 83948289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).