[4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol

C12H18N2O — CID 83854326

IUPAC[4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol
SMILESCN1CCC(CN)(CO)c2ccccc21
InChIInChI=1S/C12H18N2O/c1-14-7-6-12(8-13,9-15)10-4-2-3-5-11(10)14/h2-5,15H,6-9,13H2,1H3
InChIKeyBGDFTZDRBPAIML-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.72
Rot. Bonds2

About [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol

[4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol (PubChem CID 83854326) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol.

Molecular Properties

Compound Name[4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol
PubChem CID83854326
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol
SMILESCN1CCC(CN)(CO)c2ccccc21
InChIInChI=1S/C12H18N2O/c1-14-7-6-12(8-13,9-15)10-4-2-3-5-11(10)14/h2-5,15H,6-9,13H2,1H3
InChIKeyBGDFTZDRBPAIML-UHFFFAOYSA-N
XLogP0.72
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4S)-4-benzyl-1-methyl-2,3-dihydroquinolin-4-ol
CID 125493981
1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-carboxylic acid
CID 84682733
3-(2-aminoethyl)-1-methyl-2H-indol-3-ol
CID 82402600
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanamine
CID 28806962
2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine
CID 86712779
ethyl 1-methylspiro[2H-indole-3,4'-piperidine]-1'-carboxylate
CID 143140741
1-[2-[1-(aminomethyl)cyclobutyl]phenyl]-3-methylimidazolidin-2-one
CID 117402473
(1,5-dimethyl-3,4-dihydro-2H-1,5-benzodiazepin-4-yl)methanamine
CID 69238197
1-(aminomethyl)-2-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethyl]cyclopentan-1-ol
CID 79587863
[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol
CID 63776974
1-[2-[1-(aminomethyl)cyclobutyl]phenyl]-4-methylpiperazine-2,3-dione
CID 117463810
1-[2-[1-(aminomethyl)cyclopentyl]phenyl]-4-methylpiperazine-2,3-dione
CID 117485626

Frequently Asked Questions

What is the IUPAC name of [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol?
The IUPAC name of [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol (CID 83854326) is [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol.
What is the SMILES notation for [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol?
The canonical SMILES for [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol is CN1CCC(CN)(CO)c2ccccc21.
What is the InChIKey of [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol?
The InChIKey is BGDFTZDRBPAIML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-14-7-6-12(8-13,9-15)10-4-2-3-5-11(10)14/h2-5,15H,6-9,13H2,1H3.
What are the key properties of [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol?
[4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol has a molecular weight of 206.29 g/mol, XLogP of 0.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(aminomethyl)-1-methyl-2,3-dihydroquinolin-4-yl]methanol is sourced from PubChem (CID 83854326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).