2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine

C15H22N2 — CID 82495320

IUPAC2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine
SMILESCCc1cccc2c(C(C)CN)c(C)n(C)c12
InChIInChI=1S/C15H22N2/c1-5-12-7-6-8-13-14(10(2)9-16)11(3)17(4)15(12)13/h6-8,10H,5,9,16H2,1-4H3
InChIKeyYERXXXBPQIZKOL-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.11
Rot. Bonds3

About 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine

2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine (PubChem CID 82495320) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine
PubChem CID82495320
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine
SMILESCCc1cccc2c(C(C)CN)c(C)n(C)c12
InChIInChI=1S/C15H22N2/c1-5-12-7-6-8-13-14(10(2)9-16)11(3)17(4)15(12)13/h6-8,10H,5,9,16H2,1-4H3
InChIKeyYERXXXBPQIZKOL-UHFFFAOYSA-N
XLogP3.11
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

1-(7-ethyl-1,2-dimethylindol-3-yl)-N,N-dimethylethane-1,2-diamine
CID 82500433
2-(7-chloro-1,2-dimethylindol-3-yl)propan-1-amine
CID 82496910
2-(5-ethyl-1,2-dimethylindol-3-yl)propan-1-amine
CID 82495226
3-methyl-2-(1,2,7-trimethylindol-3-yl)butan-1-amine
CID 82497735
7-ethyl-1,2-dimethylindole-3-carboxylic acid
CID 82493307
5-(7-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine
CID 84742263
5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine
CID 84742218
1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine
CID 84636329
2-amino-1-(7-fluoro-1,2-dimethylindol-3-yl)ethanol
CID 82494429
1-ethyl-9-methylcarbazole
CID 21455608
2-(7-ethyl-1-methylindol-3-yl)-3-methylbutan-1-amine
CID 82497776
2-(5,7-dimethoxy-1,2-dimethylindol-3-yl)propan-1-amine
CID 82501140

Frequently Asked Questions

What is the IUPAC name of 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine?
The IUPAC name of 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine (CID 82495320) is 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine.
What is the SMILES notation for 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine?
The canonical SMILES for 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine is CCc1cccc2c(C(C)CN)c(C)n(C)c12.
What is the InChIKey of 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine?
The InChIKey is YERXXXBPQIZKOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-5-12-7-6-8-13-14(10(2)9-16)11(3)17(4)15(12)13/h6-8,10H,5,9,16H2,1-4H3.
What are the key properties of 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine?
2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine has a molecular weight of 230.35 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-ethyl-1,2-dimethylindol-3-yl)propan-1-amine is sourced from PubChem (CID 82495320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).