(7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride

C11H16ClNO — CID 91928406

IUPAC(7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride
SMILESCc1ccc2c(c1)CNC(CO)C2.Cl
InChIInChI=1S/C11H15NO.ClH/c1-8-2-3-9-5-11(7-13)12-6-10(9)4-8;/h2-4,11-13H,5-7H2,1H3;1H
InChIKeyLHRXSZZNCJVWSS-UHFFFAOYSA-N
MW213.71 g/mol
LogP1.42
Rot. Bonds1

About (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride

(7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride (PubChem CID 91928406) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride.

Molecular Properties

Compound Name(7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride
PubChem CID91928406
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name(7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride
SMILESCc1ccc2c(c1)CNC(CO)C2.Cl
InChIInChI=1S/C11H15NO.ClH/c1-8-2-3-9-5-11(7-13)12-6-10(9)4-8;/h2-4,11-13H,5-7H2,1H3;1H
InChIKeyLHRXSZZNCJVWSS-UHFFFAOYSA-N
XLogP1.42
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(fluoromethyl)-6-methyl-1,2,3,4-tetrahydroisoquinoline
CID 84718259
[(3R)-6-iodo-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
CID 130961541
[(3R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
CID 39345525
[(3S)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
CID 130682443
N-[(6-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]ethanamine
CID 105456803
[(1R)-6-methyl-2,3-dihydro-1H-isoindol-1-yl]methanol
CID 130741067
methyl (3R)-7-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
CID 67096009
(2-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-6-yl)methanol
CID 84659242
(3R)-7-methyl-3-phenyl-1,2,3,4-tetrahydroisoquinoline
CID 101369322
(7-thiomorpholin-4-ylsulfonyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride
CID 11245477
3-fluoro-6-methyl-1,2,3,4-tetrahydroisoquinoline
CID 123699781
3-(methylaminomethyl)-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 105446246

Frequently Asked Questions

What is the IUPAC name of (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride?
The IUPAC name of (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride (CID 91928406) is (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride.
What is the SMILES notation for (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride?
The canonical SMILES for (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride is Cc1ccc2c(c1)CNC(CO)C2.Cl.
What is the InChIKey of (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride?
The InChIKey is LHRXSZZNCJVWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.ClH/c1-8-2-3-9-5-11(7-13)12-6-10(9)4-8;/h2-4,11-13H,5-7H2,1H3;1H.
What are the key properties of (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride?
(7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanol;hydrochloride is sourced from PubChem (CID 91928406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).