(1-ethyl-4-methoxyindol-2-yl)methanol

C12H15NO2 — CID 117120546

IUPAC(1-ethyl-4-methoxyindol-2-yl)methanol
SMILESCCn1c(CO)cc2c(OC)cccc21
InChIInChI=1S/C12H15NO2/c1-3-13-9(8-14)7-10-11(13)5-4-6-12(10)15-2/h4-7,14H,3,8H2,1-2H3
InChIKeyVKXSDDOXRQHSOD-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.16
Rot. Bonds3

About (1-ethyl-4-methoxyindol-2-yl)methanol

(1-ethyl-4-methoxyindol-2-yl)methanol (PubChem CID 117120546) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is (1-ethyl-4-methoxyindol-2-yl)methanol.

Molecular Properties

Compound Name(1-ethyl-4-methoxyindol-2-yl)methanol
PubChem CID117120546
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name(1-ethyl-4-methoxyindol-2-yl)methanol
SMILESCCn1c(CO)cc2c(OC)cccc21
InChIInChI=1S/C12H15NO2/c1-3-13-9(8-14)7-10-11(13)5-4-6-12(10)15-2/h4-7,14H,3,8H2,1-2H3
InChIKeyVKXSDDOXRQHSOD-UHFFFAOYSA-N
XLogP2.16
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-ethyl-4-methoxyindol-2-yl)-2-methylpropanoic acid
CID 117120626
2-(1-ethyl-4-methoxyindol-2-yl)propan-2-ol
CID 117120548
1-ethyl-2-[(2-methoxyphenoxy)methyl]indol-4-ol
CID 117173851
1-benzyl-4-methoxy-2-propylindole
CID 16741747
1-ethyl-4-methoxy-2-(4,4,5,5-tetraethyl-1,3,2-dioxaborolan-2-yl)indole
CID 142779879
1-ethyl-2-[(4-methoxyphenoxy)methyl]indol-4-ol
CID 117173947
2-(4-methoxy-2-methylindol-1-yl)acetic acid
CID 18735254
2-(ethoxymethyl)-1-ethylindol-4-ol
CID 117173988
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]acetamide
CID 53196135
(9-ethyl-5,6-dimethoxycarbazol-3-yl)methanol
CID 143174374
4-methoxy-1-methylindol-2-ol
CID 57183322
1-ethyl-2-(ethylaminomethyl)indol-4-ol
CID 117173987

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-4-methoxyindol-2-yl)methanol?
The IUPAC name of (1-ethyl-4-methoxyindol-2-yl)methanol (CID 117120546) is (1-ethyl-4-methoxyindol-2-yl)methanol.
What is the SMILES notation for (1-ethyl-4-methoxyindol-2-yl)methanol?
The canonical SMILES for (1-ethyl-4-methoxyindol-2-yl)methanol is CCn1c(CO)cc2c(OC)cccc21.
What is the InChIKey of (1-ethyl-4-methoxyindol-2-yl)methanol?
The InChIKey is VKXSDDOXRQHSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-3-13-9(8-14)7-10-11(13)5-4-6-12(10)15-2/h4-7,14H,3,8H2,1-2H3.
What are the key properties of (1-ethyl-4-methoxyindol-2-yl)methanol?
(1-ethyl-4-methoxyindol-2-yl)methanol has a molecular weight of 205.26 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-4-methoxyindol-2-yl)methanol is sourced from PubChem (CID 117120546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).