1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine

C16H22N2 — CID 63556200

IUPAC1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine
SMILESCc1ccc2c(ccn2CCNC(C)C2CC2)c1
InChIInChI=1S/C16H22N2/c1-12-3-6-16-15(11-12)7-9-18(16)10-8-17-13(2)14-4-5-14/h3,6-7,9,11,13-14,17H,4-5,8,10H2,1-2H3
InChIKeyZDRZYMWQJBHTRT-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.34
Rot. Bonds5

About 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine

1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine (PubChem CID 63556200) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine
PubChem CID63556200
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine
SMILESCc1ccc2c(ccn2CCNC(C)C2CC2)c1
InChIInChI=1S/C16H22N2/c1-12-3-6-16-15(11-12)7-9-18(16)10-8-17-13(2)14-4-5-14/h3,6-7,9,11,13-14,17H,4-5,8,10H2,1-2H3
InChIKeyZDRZYMWQJBHTRT-UHFFFAOYSA-N
XLogP3.34
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine (CID 63556200) is 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine is Cc1ccc2c(ccn2CCNC(C)C2CC2)c1.
What is the InChIKey of 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine?
The InChIKey is ZDRZYMWQJBHTRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-12-3-6-16-15(11-12)7-9-18(16)10-8-17-13(2)14-4-5-14/h3,6-7,9,11,13-14,17H,4-5,8,10H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine?
1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine has a molecular weight of 242.37 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[2-(5-methylindol-1-yl)ethyl]ethanamine is sourced from PubChem (CID 63556200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).