1-(cyclopropylmethyl)-4-ethoxyindole

C14H17NO — CID 83173607

IUPAC1-(cyclopropylmethyl)-4-ethoxyindole
SMILESCCOc1cccc2c1ccn2CC1CC1
InChIInChI=1S/C14H17NO/c1-2-16-14-5-3-4-13-12(14)8-9-15(13)10-11-6-7-11/h3-5,8-9,11H,2,6-7,10H2,1H3
InChIKeyLKGBBEFNFBTMBN-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.45
Rot. Bonds4

About 1-(cyclopropylmethyl)-4-ethoxyindole

1-(cyclopropylmethyl)-4-ethoxyindole (PubChem CID 83173607) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-ethoxyindole.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-ethoxyindole
PubChem CID83173607
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name1-(cyclopropylmethyl)-4-ethoxyindole
SMILESCCOc1cccc2c1ccn2CC1CC1
InChIInChI=1S/C14H17NO/c1-2-16-14-5-3-4-13-12(14)8-9-15(13)10-11-6-7-11/h3-5,8-9,11H,2,6-7,10H2,1H3
InChIKeyLKGBBEFNFBTMBN-UHFFFAOYSA-N
XLogP3.45
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethoxy-1-(oxan-4-ylmethyl)indole
CID 83174245
1-(cyclopropylmethyl)-4-phenylmethoxyindole
CID 69006016
2-(4-ethoxyindol-1-yl)ethanol
CID 83174332
4-ethoxy-1-(2-pyrrolidin-1-ylethyl)indole
CID 83173234
4-ethoxy-1-(2-methylbutyl)indole
CID 83173509
2-(4-ethoxyindol-1-yl)acetic acid
CID 83162473
4-[[4-[1-(cyclopropylmethyl)indol-4-yl]oxypiperidin-1-yl]methyl]-1,3-oxazole
CID 126952428
4-ethoxy-1-(phenylmethoxymethyl)indole
CID 102940706
4-ethoxy-1-(pyridin-2-ylmethyl)indole
CID 83174156
4-ethoxy-1-[(5-ethylthiophen-2-yl)methyl]indole
CID 83173603
2-(4-ethoxyindol-1-yl)-N,N-diethylacetamide
CID 83174508
1-(2-bicyclo[2.2.1]heptanylmethyl)-4-propoxyindole
CID 83165975

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4-ethoxyindole?
The IUPAC name of 1-(cyclopropylmethyl)-4-ethoxyindole (CID 83173607) is 1-(cyclopropylmethyl)-4-ethoxyindole.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-ethoxyindole?
The canonical SMILES for 1-(cyclopropylmethyl)-4-ethoxyindole is CCOc1cccc2c1ccn2CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-ethoxyindole?
The InChIKey is LKGBBEFNFBTMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-2-16-14-5-3-4-13-12(14)8-9-15(13)10-11-6-7-11/h3-5,8-9,11H,2,6-7,10H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-4-ethoxyindole?
1-(cyclopropylmethyl)-4-ethoxyindole has a molecular weight of 215.30 g/mol, XLogP of 3.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-ethoxyindole is sourced from PubChem (CID 83173607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).