(2-aminoquinolin-5-yl)-dideuteriomethanol

C10H10N2O — CID 118689161

IUPAC(2-aminoquinolin-5-yl)-dideuteriomethanol
SMILES[2H]C([2H])(O)c1cccc2nc(N)ccc12
InChIInChI=1S/C10H10N2O/c11-10-5-4-8-7(6-13)2-1-3-9(8)12-10/h1-5,13H,6H2,(H2,11,12)/i6D2
InChIKeyMMNNDXPHXYPKTN-NCYHJHSESA-N
MW176.22 g/mol
LogP1.31
Rot. Bonds1

About (2-aminoquinolin-5-yl)-dideuteriomethanol

(2-aminoquinolin-5-yl)-dideuteriomethanol (PubChem CID 118689161) has the molecular formula C10H10N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is (2-aminoquinolin-5-yl)-dideuteriomethanol.

Molecular Properties

Compound Name(2-aminoquinolin-5-yl)-dideuteriomethanol
PubChem CID118689161
Molecular FormulaC10H10N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name(2-aminoquinolin-5-yl)-dideuteriomethanol
SMILES[2H]C([2H])(O)c1cccc2nc(N)ccc12
InChIInChI=1S/C10H10N2O/c11-10-5-4-8-7(6-13)2-1-3-9(8)12-10/h1-5,13H,6H2,(H2,11,12)/i6D2
InChIKeyMMNNDXPHXYPKTN-NCYHJHSESA-N
XLogP1.31
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2-aminoquinolin-5-yl)-dideuteriomethanol 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

5-ethylquinolin-2-amine
CID 59551845
(2R)-2-amino-3-(2-aminoquinolin-5-yl)propanoic acid
CID 177277795
5-N-methylquinoline-2,5-diamine
CID 59551884
2-amino-N,N-dimethylquinoline-5-carboxamide
CID 118658010
5-(trifluoromethoxy)quinolin-2-amine
CID 125425664
2-aminoquinoline-5,6-diol
CID 137224680
2-chloro-5-[dideuterio(methoxy)methyl]quinoline
CID 118689159
quinolin-2-amine;zirconium
CID 175251209
CID 158897445
CID 158897445
2-chloro-5-ethylquinoline;ethane
CID 143687373
[6-(hydroxymethyl)phenazin-1-yl]methanol
CID 44607162
deuterio-(2-phenylquinolin-4-yl)methanol
CID 88591215

Frequently Asked Questions

What is the IUPAC name of (2-aminoquinolin-5-yl)-dideuteriomethanol?
The IUPAC name of (2-aminoquinolin-5-yl)-dideuteriomethanol (CID 118689161) is (2-aminoquinolin-5-yl)-dideuteriomethanol.
What is the SMILES notation for (2-aminoquinolin-5-yl)-dideuteriomethanol?
The canonical SMILES for (2-aminoquinolin-5-yl)-dideuteriomethanol is [2H]C([2H])(O)c1cccc2nc(N)ccc12.
What is the InChIKey of (2-aminoquinolin-5-yl)-dideuteriomethanol?
The InChIKey is MMNNDXPHXYPKTN-NCYHJHSESA-N. The full InChI is InChI=1S/C10H10N2O/c11-10-5-4-8-7(6-13)2-1-3-9(8)12-10/h1-5,13H,6H2,(H2,11,12)/i6D2.
What are the key properties of (2-aminoquinolin-5-yl)-dideuteriomethanol?
(2-aminoquinolin-5-yl)-dideuteriomethanol has a molecular weight of 176.22 g/mol, XLogP of 1.31, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminoquinolin-5-yl)-dideuteriomethanol is sourced from PubChem (CID 118689161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).