7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine

C15H25N3O — CID 129236529

IUPAC7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine
SMILESCC1=C(C)N(C)C2=C(OCCN(C)C)C=CC(N)C12
InChIInChI=1S/C15H25N3O/c1-10-11(2)18(5)15-13(19-9-8-17(3)4)7-6-12(16)14(10)15/h6-7,12,14H,8-9,16H2,1-5H3
InChIKeyMSYZVRZJKURRQW-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.53
Rot. Bonds4

About 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine

7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine (PubChem CID 129236529) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine.

Molecular Properties

Compound Name7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine
PubChem CID129236529
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine
SMILESCC1=C(C)N(C)C2=C(OCCN(C)C)C=CC(N)C12
InChIInChI=1S/C15H25N3O/c1-10-11(2)18(5)15-13(19-9-8-17(3)4)7-6-12(16)14(10)15/h6-7,12,14H,8-9,16H2,1-5H3
InChIKeyMSYZVRZJKURRQW-UHFFFAOYSA-N
XLogP1.53
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine?
The IUPAC name of 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine (CID 129236529) is 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine.
What is the SMILES notation for 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine?
The canonical SMILES for 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine is CC1=C(C)N(C)C2=C(OCCN(C)C)C=CC(N)C12.
What is the InChIKey of 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine?
The InChIKey is MSYZVRZJKURRQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-10-11(2)18(5)15-13(19-9-8-17(3)4)7-6-12(16)14(10)15/h6-7,12,14H,8-9,16H2,1-5H3.
What are the key properties of 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine?
7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine has a molecular weight of 263.38 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(dimethylamino)ethoxy]-1,2,3-trimethyl-3a,4-dihydroindol-4-amine is sourced from PubChem (CID 129236529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).