2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol

C19H23NO — CID 44563258

IUPAC2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol
SMILESCNCC1(O)Cc2ccccc2C1Cc1ccccc1C
InChIInChI=1S/C19H23NO/c1-14-7-3-4-8-15(14)11-18-17-10-6-5-9-16(17)12-19(18,21)13-20-2/h3-10,18,20-21H,11-13H2,1-2H3
InChIKeyIOEFEBQWPLLQHN-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.83
Rot. Bonds4

About 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol

2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol (PubChem CID 44563258) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol.

Molecular Properties

Compound Name2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol
PubChem CID44563258
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol
SMILESCNCC1(O)Cc2ccccc2C1Cc1ccccc1C
InChIInChI=1S/C19H23NO/c1-14-7-3-4-8-15(14)11-18-17-10-6-5-9-16(17)12-19(18,21)13-20-2/h3-10,18,20-21H,11-13H2,1-2H3
InChIKeyIOEFEBQWPLLQHN-UHFFFAOYSA-N
XLogP2.83
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

9-(1-Aminopropan-2-yl)-9H-fluoren-9-ol--hydrogen chloride (1/1)
CID 27024
1-Indanol, 3-(1-methyl-4-piperidyl)-1-phenyl-
CID 210019
Dietor
CID 65623
2-Methyl-3-(methylamino)-1,1-diphenylpropan-2-ol;hydrochloride
CID 12549119
9-Fluorenol, 9-(1-(pyrrolidinyl)-2-propyl)-, hydrochloride
CID 54124
3-Phenyl-1-(piperidin-2-yl)-2,3-dihydro-1H-inden-1-ol
CID 210020
2-(aminomethyl)-2,3-dihydro-1H-inden-2-ol
CID 25895951
1-[(methylamino)methyl]-2,3-dihydro-1H-inden-1-ol
CID 62772941
(9H-fluoren-9-yl)methyl N-(2-hydroxy-2-methylpropyl)carbamate
CID 65109560
2-(aminomethyl)-2,3-dihydro-1H-inden-2-ol hydrochloride
CID 165651967
9-(1-Aminopropan-2-yl)fluoren-9-ol
CID 27025
2-[(2S)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-2-ol
CID 11095706

Frequently Asked Questions

What is the IUPAC name of 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
The IUPAC name of 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol (CID 44563258) is 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol.
What is the SMILES notation for 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
The canonical SMILES for 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol is CNCC1(O)Cc2ccccc2C1Cc1ccccc1C.
What is the InChIKey of 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
The InChIKey is IOEFEBQWPLLQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14-7-3-4-8-15(14)11-18-17-10-6-5-9-16(17)12-19(18,21)13-20-2/h3-10,18,20-21H,11-13H2,1-2H3.
What are the key properties of 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol has a molecular weight of 281.40 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylaminomethyl)-1-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol is sourced from PubChem (CID 44563258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).