(6-methoxyquinolin-2-yl)methanamine;dihydrochloride

C11H14Cl2N2O — CID 47002728

IUPAC(6-methoxyquinolin-2-yl)methanamine;dihydrochloride
SMILESCOc1ccc2nc(CN)ccc2c1.Cl.Cl
InChIInChI=1S/C11H12N2O.2ClH/c1-14-10-4-5-11-8(6-10)2-3-9(7-12)13-11;;/h2-6H,7,12H2,1H3;2*1H
InChIKeyPFELIUKWLWELKI-UHFFFAOYSA-N
MW261.15 g/mol
LogP2.55
Rot. Bonds2

About (6-methoxyquinolin-2-yl)methanamine;dihydrochloride

(6-methoxyquinolin-2-yl)methanamine;dihydrochloride (PubChem CID 47002728) has the molecular formula C11H14Cl2N2O and a molecular weight of 261.15 g/mol. Its IUPAC name is (6-methoxyquinolin-2-yl)methanamine;dihydrochloride.

Molecular Properties

Compound Name(6-methoxyquinolin-2-yl)methanamine;dihydrochloride
PubChem CID47002728
Molecular FormulaC11H14Cl2N2O
Molecular Weight261.15 g/mol
Exact Mass260.05
IUPAC Name(6-methoxyquinolin-2-yl)methanamine;dihydrochloride
SMILESCOc1ccc2nc(CN)ccc2c1.Cl.Cl
InChIInChI=1S/C11H12N2O.2ClH/c1-14-10-4-5-11-8(6-10)2-3-9(7-12)13-11;;/h2-6H,7,12H2,1H3;2*1H
InChIKeyPFELIUKWLWELKI-UHFFFAOYSA-N
XLogP2.55
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.15
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(6-methoxyquinolin-2-yl)-N,N-dimethylpropan-1-amine
CID 23204412
(6-methoxyquinolin-2-yl)methylphosphonic acid
CID 67774367
(1S)-2-amino-1-(6-methoxynaphthalen-2-yl)ethanol
CID 28743407
(1R)-1-(6-methoxynaphthalen-2-yl)ethane-1,2-diamine;hydrochloride
CID 171218891
2-butan-2-yl-6-methoxyquinoline
CID 142826325
2-(2,6-dimethoxyquinolin-3-yl)ethanamine
CID 170868890
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294
(1S)-1-(6-methoxyquinolin-2-yl)-2-phenylethanamine
CID 146479702
2-(aminomethyl)-7-methoxy-N-methylquinolin-4-amine
CID 84682953
2-(3,5-dimethylphenyl)-6-methoxyquinoline
CID 58871188
(2S)-2-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 93286235
1-(4-methoxyphenyl)-2-quinolin-2-ylethanamine
CID 43118775

Frequently Asked Questions

What is the IUPAC name of (6-methoxyquinolin-2-yl)methanamine;dihydrochloride?
The IUPAC name of (6-methoxyquinolin-2-yl)methanamine;dihydrochloride (CID 47002728) is (6-methoxyquinolin-2-yl)methanamine;dihydrochloride.
What is the SMILES notation for (6-methoxyquinolin-2-yl)methanamine;dihydrochloride?
The canonical SMILES for (6-methoxyquinolin-2-yl)methanamine;dihydrochloride is COc1ccc2nc(CN)ccc2c1.Cl.Cl.
What is the InChIKey of (6-methoxyquinolin-2-yl)methanamine;dihydrochloride?
The InChIKey is PFELIUKWLWELKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O.2ClH/c1-14-10-4-5-11-8(6-10)2-3-9(7-12)13-11;;/h2-6H,7,12H2,1H3;2*1H.
What are the key properties of (6-methoxyquinolin-2-yl)methanamine;dihydrochloride?
(6-methoxyquinolin-2-yl)methanamine;dihydrochloride has a molecular weight of 261.15 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxyquinolin-2-yl)methanamine;dihydrochloride is sourced from PubChem (CID 47002728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).