N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine

C14H21NO — CID 107683424

IUPACN-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CCc2cc(OCC(C)C)ccc21
InChIInChI=1S/C14H21NO/c1-10(2)9-16-12-5-6-13-11(8-12)4-7-14(13)15-3/h5-6,8,10,14-15H,4,7,9H2,1-3H3
InChIKeyIUDXNYBGILPSLJ-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.93
Rot. Bonds4

About N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine

N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine (PubChem CID 107683424) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine
PubChem CID107683424
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CCc2cc(OCC(C)C)ccc21
InChIInChI=1S/C14H21NO/c1-10(2)9-16-12-5-6-13-11(8-12)4-7-14(13)15-3/h5-6,8,10,14-15H,4,7,9H2,1-3H3
InChIKeyIUDXNYBGILPSLJ-UHFFFAOYSA-N
XLogP2.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,1,1-trifluoro-3-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]propan-2-ol
CID 107683257
5-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pentan-1-ol
CID 107683313
N-methyl-5-(3,3,3-trifluoropropoxy)-2,3-dihydro-1H-inden-1-amine
CID 107683376
2-methyl-4-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butan-2-ol
CID 107683344
5-[(2,3-difluorophenyl)methoxy]-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 107683246
ethyl 2-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]acetate
CID 107683229
N-methyl-4-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide
CID 107683326
5-[(5-chloro-2-fluorophenyl)methoxy]-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 107683270
(1S)-5-(2,4-dimethylpentoxy)-2,3-dihydro-1H-inden-1-amine
CID 114200067
N-cyclopropyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]propanamide
CID 107683434
N-methyl-5-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 107683362
N-methyl-5-[(2-methyltetrazol-5-yl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 107683464

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine (CID 107683424) is N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine is CNC1CCc2cc(OCC(C)C)ccc21.
What is the InChIKey of N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is IUDXNYBGILPSLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)9-16-12-5-6-13-11(8-12)4-7-14(13)15-3/h5-6,8,10,14-15H,4,7,9H2,1-3H3.
What are the key properties of N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine?
N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 107683424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).