5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine

C15H24N2O — CID 81101497

IUPAC5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine
SMILESCOCCCC(N)CN1c2ccccc2CC1C
InChIInChI=1S/C15H24N2O/c1-12-10-13-6-3-4-8-15(13)17(12)11-14(16)7-5-9-18-2/h3-4,6,8,12,14H,5,7,9-11,16H2,1-2H3
InChIKeyYCQYYBGIBAKRAU-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.19
Rot. Bonds6

About 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine

5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine (PubChem CID 81101497) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine.

Molecular Properties

Compound Name5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine
PubChem CID81101497
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine
SMILESCOCCCC(N)CN1c2ccccc2CC1C
InChIInChI=1S/C15H24N2O/c1-12-10-13-6-3-4-8-15(13)17(12)11-14(16)7-5-9-18-2/h3-4,6,8,12,14H,5,7,9-11,16H2,1-2H3
InChIKeyYCQYYBGIBAKRAU-UHFFFAOYSA-N
XLogP2.19
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3-(2-methyl-2,3-dihydroindol-1-yl)propan-1-amine
CID 43367603
1-cyclopentyl-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 113447993
1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-ol
CID 62044766
2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]pentan-1-amine
CID 65228439
2-(2-methyl-2,3-dihydroindol-1-yl)-1-thiophen-2-ylethanamine
CID 115287646
1-(3,3-diethoxypropyl)-2-methyl-2,3-dihydroindole
CID 63628082
3,3,3-trifluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]propanethioamide
CID 103368487
5-methoxy-1-(3-phenylpyrrolidin-1-yl)pentan-2-amine
CID 81102007
2-ethoxy-3-(2-methyl-2,3-dihydroindol-1-yl)propanoic acid
CID 63067031
1-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclopropan-1-amine
CID 65458877
1-(4-bromobutyl)-2-methyl-2,3-dihydroindole
CID 61286704
2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 22200023

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine?
The IUPAC name of 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine (CID 81101497) is 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine.
What is the SMILES notation for 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine?
The canonical SMILES for 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine is COCCCC(N)CN1c2ccccc2CC1C.
What is the InChIKey of 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine?
The InChIKey is YCQYYBGIBAKRAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-10-13-6-3-4-8-15(13)17(12)11-14(16)7-5-9-18-2/h3-4,6,8,12,14H,5,7,9-11,16H2,1-2H3.
What are the key properties of 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine?
5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-amine is sourced from PubChem (CID 81101497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).