1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine

C11H15N3O — CID 170895159

IUPAC1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine
SMILESCOc1cccc2cc(C(N)CN)[nH]c12
InChIInChI=1S/C11H15N3O/c1-15-10-4-2-3-7-5-9(8(13)6-12)14-11(7)10/h2-5,8,14H,6,12-13H2,1H3
InChIKeyBFDXTHZEEYOJGK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.13
Rot. Bonds3

About 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine

1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine (PubChem CID 170895159) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine
PubChem CID170895159
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine
SMILESCOc1cccc2cc(C(N)CN)[nH]c12
InChIInChI=1S/C11H15N3O/c1-15-10-4-2-3-7-5-9(8(13)6-12)14-11(7)10/h2-5,8,14H,6,12-13H2,1H3
InChIKeyBFDXTHZEEYOJGK-UHFFFAOYSA-N
XLogP1.13
TPSA77.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(7-methoxy-1H-indol-2-yl)ethanamine
CID 65332606
1-(2,6-dimethoxyphenyl)ethane-1,2-diamine
CID 22756535
ethane;7-methoxy-2-methyl-1H-indole
CID 143863749
methyl 2-amino-3-(7-methoxy-1H-indol-2-yl)propanoate
CID 170884501
(1S)-1-(2,6-dimethoxyphenyl)ethane-1,2-diamine;hydrochloride
CID 171201155
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599
(1S)-1-(2,3-dimethoxyphenyl)ethane-1,2-diamine
CID 55278892
1-(2-methoxy-6-methylphenyl)ethane-1,2-diamine
CID 55283458
(7-methoxy-1H-indol-2-yl)-methyl-methylidene-λ4-sulfane
CID 123990604
ethyl 8-methoxy-2-oxo-1H-quinoline-3-carboxylate
CID 22509332
8-methoxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 22690286
N-butan-2-yl-7-methoxy-1H-indole-2-carboxamide
CID 110848409

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine?
The IUPAC name of 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine (CID 170895159) is 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine.
What is the SMILES notation for 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine?
The canonical SMILES for 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine is COc1cccc2cc(C(N)CN)[nH]c12.
What is the InChIKey of 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine?
The InChIKey is BFDXTHZEEYOJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-15-10-4-2-3-7-5-9(8(13)6-12)14-11(7)10/h2-5,8,14H,6,12-13H2,1H3.
What are the key properties of 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine?
1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine has a molecular weight of 205.26 g/mol, XLogP of 1.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxy-1H-indol-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 170895159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).