2-methyl-1,2,3,4-tetrahydroquinoline;titanium

C10H13NTi — CID 158265975

IUPAC2-methyl-1,2,3,4-tetrahydroquinoline;titanium
SMILESCC1CCc2ccccc2N1.[Ti]
InChIInChI=1S/C10H13N.Ti/c1-8-6-7-9-4-2-3-5-10(9)11-8;/h2-5,8,11H,6-7H2,1H3;
InChIKeyGILDOAFDQQQPQL-UHFFFAOYSA-N
MW195.09 g/mol
LogP2.43
Rot. Bonds

About 2-methyl-1,2,3,4-tetrahydroquinoline;titanium

2-methyl-1,2,3,4-tetrahydroquinoline;titanium (PubChem CID 158265975) has the molecular formula C10H13NTi and a molecular weight of 195.09 g/mol. Its IUPAC name is 2-methyl-1,2,3,4-tetrahydroquinoline;titanium.

Molecular Properties

Compound Name2-methyl-1,2,3,4-tetrahydroquinoline;titanium
PubChem CID158265975
Molecular FormulaC10H13NTi
Molecular Weight195.09 g/mol
Exact Mass195.05
IUPAC Name2-methyl-1,2,3,4-tetrahydroquinoline;titanium
SMILESCC1CCc2ccccc2N1.[Ti]
InChIInChI=1S/C10H13N.Ti/c1-8-6-7-9-4-2-3-5-10(9)11-8;/h2-5,8,11H,6-7H2,1H3;
InChIKeyGILDOAFDQQQPQL-UHFFFAOYSA-N
XLogP2.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.09
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-methyl-2,3-dihydro-1H-indole;hydrochloride
CID 155819591
7-bromo-2-methyl-1,2,3,4-tetrahydroquinoline
CID 70875781
2,6-dimethyl-1,2,3,4-tetrahydroquinoline
CID 13094330
trimethyl(1,2,3,4-tetrahydroquinolin-2-yl)silane
CID 15654414
formic acid;2-methyl-2,3-dihydro-1H-indole
CID 144722451
2-chloro-1,2,3,4-tetrahydroquinoline;methyl formate
CID 142459646
6-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 12715494
2-methyl-2,3-dihydro-1H-indole;2-methyl-1,3-dihydroisoindole
CID 158613443
1,2,3,4-tetrahydroquinolin-2-ylhydrazine
CID 91755653
2-(iodomethyl)-1,2,3,4-tetrahydroquinoline
CID 11778039
(2S)-2,5-dimethyl-1,2,3,4-tetrahydroquinoline
CID 124706639
6-(3,4-dihydro-2H-quinolin-1-yl)-2-methyl-1,2,3,4-tetrahydroquinoline
CID 81218003

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,2,3,4-tetrahydroquinoline;titanium?
The IUPAC name of 2-methyl-1,2,3,4-tetrahydroquinoline;titanium (CID 158265975) is 2-methyl-1,2,3,4-tetrahydroquinoline;titanium.
What is the SMILES notation for 2-methyl-1,2,3,4-tetrahydroquinoline;titanium?
The canonical SMILES for 2-methyl-1,2,3,4-tetrahydroquinoline;titanium is CC1CCc2ccccc2N1.[Ti].
What is the InChIKey of 2-methyl-1,2,3,4-tetrahydroquinoline;titanium?
The InChIKey is GILDOAFDQQQPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N.Ti/c1-8-6-7-9-4-2-3-5-10(9)11-8;/h2-5,8,11H,6-7H2,1H3;.
What are the key properties of 2-methyl-1,2,3,4-tetrahydroquinoline;titanium?
2-methyl-1,2,3,4-tetrahydroquinoline;titanium has a molecular weight of 195.09 g/mol, XLogP of 2.43, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,2,3,4-tetrahydroquinoline;titanium is sourced from PubChem (CID 158265975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).