N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine

C14H22N2O — CID 55085162

IUPACN-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine
SMILESCOCC(C)NCCN1CCc2ccccc21
InChIInChI=1S/C14H22N2O/c1-12(11-17-2)15-8-10-16-9-7-13-5-3-4-6-14(13)16/h3-6,12,15H,7-11H2,1-2H3
InChIKeyDRMXXTRIXUBMCV-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.67
Rot. Bonds6

About N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine

N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine (PubChem CID 55085162) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine.

Molecular Properties

Compound NameN-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine
PubChem CID55085162
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine
SMILESCOCC(C)NCCN1CCc2ccccc21
InChIInChI=1S/C14H22N2O/c1-12(11-17-2)15-8-10-16-9-7-13-5-3-4-6-14(13)16/h3-6,12,15H,7-11H2,1-2H3
InChIKeyDRMXXTRIXUBMCV-UHFFFAOYSA-N
XLogP1.67
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]pentan-2-amine
CID 55085658
(2S)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-(1,2,4-triazol-1-yl)propan-2-amine
CID 95140193
3-(2,3-dihydroindol-1-yl)-N-(2-methoxyethyl)propan-1-amine
CID 62569832
N-[3-(2,3-dihydroindol-1-yl)propyl]-1-ethylsulfonylpropan-2-amine
CID 115900693
N-[2-[4-(2-chlorophenyl)piperazin-1-yl]ethyl]-1-methoxypropan-2-amine
CID 62574171
1-(3-methylbutyl)-2,3-dihydroindole
CID 143815180
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxyethyl)ethanamine
CID 54806928
N-[2-(2,3-dihydroindol-1-yl)ethyl]-3-ethoxypropan-1-amine
CID 62573733
4-(2,3-dihydroindol-1-yl)butan-2-amine
CID 60748123
N-[3-(2,3-dihydroindol-1-yl)propyl]heptan-4-amine
CID 43111286
N-[2-(2,3-dihydroindol-1-yl)ethyl]-3-methoxyaniline
CID 54806693
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenylethanamine
CID 54806649

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine?
The IUPAC name of N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine (CID 55085162) is N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine.
What is the SMILES notation for N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine?
The canonical SMILES for N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine is COCC(C)NCCN1CCc2ccccc21.
What is the InChIKey of N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine?
The InChIKey is DRMXXTRIXUBMCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12(11-17-2)15-8-10-16-9-7-13-5-3-4-6-14(13)16/h3-6,12,15H,7-11H2,1-2H3.
What are the key properties of N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine?
N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine has a molecular weight of 234.34 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-methoxypropan-2-amine is sourced from PubChem (CID 55085162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).