2-methyl-1,2,3,4-tetrahydroquinolin-5-ol

C10H13NO — CID 3065780

IUPAC2-methyl-1,2,3,4-tetrahydroquinolin-5-ol
SMILESCC1CCc2c(O)cccc2N1
InChIInChI=1S/C10H13NO/c1-7-5-6-8-9(11-7)3-2-4-10(8)12/h2-4,7,11-12H,5-6H2,1H3
InChIKeyRWIHAUCDTLMENH-UHFFFAOYSA-N
MW163.22 g/mol
LogP2.14
Rot. Bonds

About 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol

2-methyl-1,2,3,4-tetrahydroquinolin-5-ol (PubChem CID 3065780) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol.

Molecular Properties

Compound Name2-methyl-1,2,3,4-tetrahydroquinolin-5-ol
PubChem CID3065780
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name2-methyl-1,2,3,4-tetrahydroquinolin-5-ol
SMILESCC1CCc2c(O)cccc2N1
InChIInChI=1S/C10H13NO/c1-7-5-6-8-9(11-7)3-2-4-10(8)12/h2-4,7,11-12H,5-6H2,1H3
InChIKeyRWIHAUCDTLMENH-UHFFFAOYSA-N
XLogP2.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol?
The IUPAC name of 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol (CID 3065780) is 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol.
What is the SMILES notation for 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol?
The canonical SMILES for 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol is CC1CCc2c(O)cccc2N1.
What is the InChIKey of 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol?
The InChIKey is RWIHAUCDTLMENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-7-5-6-8-9(11-7)3-2-4-10(8)12/h2-4,7,11-12H,5-6H2,1H3.
What are the key properties of 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol?
2-methyl-1,2,3,4-tetrahydroquinolin-5-ol has a molecular weight of 163.22 g/mol, XLogP of 2.14, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,2,3,4-tetrahydroquinolin-5-ol is sourced from PubChem (CID 3065780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).