1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride

C11H16ClNO — CID 139026737

IUPAC1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride
SMILESCl.NCCC1(O)CCc2ccccc21
InChIInChI=1S/C11H15NO.ClH/c12-8-7-11(13)6-5-9-3-1-2-4-10(9)11;/h1-4,13H,5-8,12H2;1H
InChIKeyNLTCFFHCHNKWPQ-UHFFFAOYSA-N
MW213.71 g/mol
LogP1.59
Rot. Bonds2

About 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride

1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride (PubChem CID 139026737) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride.

Molecular Properties

Compound Name1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride
PubChem CID139026737
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride
SMILESCl.NCCC1(O)CCc2ccccc21
InChIInChI=1S/C11H15NO.ClH/c12-8-7-11(13)6-5-9-3-1-2-4-10(9)11;/h1-4,13H,5-8,12H2;1H
InChIKeyNLTCFFHCHNKWPQ-UHFFFAOYSA-N
XLogP1.59
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride
CID 203118
1-(aminomethyl)-2,3-dihydro-1H-inden-1-ol
CID 14348695
9-(1-Aminopropan-2-yl)-9H-fluoren-9-ol--hydrogen chloride (1/1)
CID 27024
4-Amino-2-phenylbutan-2-ol
CID 24975101
Dietor
CID 65623
1-But-3-enyl-2,3-dihydroinden-1-ol
CID 127005961
Fluoren-9-ol, 9-(3-piperidino-1-propynyl)-, hydrochloride
CID 16431
Fluoren-9-ol, 9-(3-(diethylamino)-1-propynyl)-, hydrochloride
CID 16435
1-Amino-2-phenylbutan-2-olato--hydrogen chlorido (1/1)
CID 17830
5H-Dibenzo(a,d)cyclohepten-5-ol, 5-(2-amino-1-methylethyl)-, hydrochloride
CID 54091
9-Fluorenol, 9-(1-(pyrrolidinyl)-2-propyl)-, hydrochloride
CID 54124
1-Indanol, 2-(alpha-aminobenzyl)-, hydrochloride, cis-(+-)-
CID 213905

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride?
The IUPAC name of 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride (CID 139026737) is 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride.
What is the SMILES notation for 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride?
The canonical SMILES for 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride is Cl.NCCC1(O)CCc2ccccc21.
What is the InChIKey of 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride?
The InChIKey is NLTCFFHCHNKWPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.ClH/c12-8-7-11(13)6-5-9-3-1-2-4-10(9)11;/h1-4,13H,5-8,12H2;1H.
What are the key properties of 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride?
1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-2,3-dihydroinden-1-ol;hydrochloride is sourced from PubChem (CID 139026737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).