(2-methylquinolin-4-yl)methanamine;dihydrochloride

C11H14Cl2N2 — CID 42946478

IUPAC(2-methylquinolin-4-yl)methanamine;dihydrochloride
SMILESCc1cc(CN)c2ccccc2n1.Cl.Cl
InChIInChI=1S/C11H12N2.2ClH/c1-8-6-9(7-12)10-4-2-3-5-11(10)13-8;;/h2-6H,7,12H2,1H3;2*1H
InChIKeyAVAORVCXKGFCCA-UHFFFAOYSA-N
MW245.15 g/mol
LogP2.85
Rot. Bonds1

About (2-methylquinolin-4-yl)methanamine;dihydrochloride

(2-methylquinolin-4-yl)methanamine;dihydrochloride (PubChem CID 42946478) has the molecular formula C11H14Cl2N2 and a molecular weight of 245.15 g/mol. Its IUPAC name is (2-methylquinolin-4-yl)methanamine;dihydrochloride.

Molecular Properties

Compound Name(2-methylquinolin-4-yl)methanamine;dihydrochloride
PubChem CID42946478
Molecular FormulaC11H14Cl2N2
Molecular Weight245.15 g/mol
Exact Mass244.05
IUPAC Name(2-methylquinolin-4-yl)methanamine;dihydrochloride
SMILESCc1cc(CN)c2ccccc2n1.Cl.Cl
InChIInChI=1S/C11H12N2.2ClH/c1-8-6-9(7-12)10-4-2-3-5-11(10)13-8;;/h2-6H,7,12H2,1H3;2*1H
InChIKeyAVAORVCXKGFCCA-UHFFFAOYSA-N
XLogP2.85
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
CID 79234339
(2-methylquinolin-4-yl)methanethiol
CID 79885955
2-(2-methylquinolin-4-yl)acetic acid
CID 79019861
(2-phenylquinolin-4-yl)methanamine;hydrochloride
CID 82025622
[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
CID 22148915
4-(isocyanomethyl)-2-methylquinoline
CID 83482593
4-(aminomethyl)-N,N-dimethylquinolin-2-amine
CID 56828443
2-methylquinolin-4-amine
CID 162035180
[1-[(2-methylquinolin-4-yl)methyl]pyrazol-4-yl]methanamine
CID 79241282
2-methyl-4-(2-methylbut-2-enyl)quinoline
CID 123480246
N'-(2-methylquinolin-4-yl)ethane-1,2-diamine;dihydrochloride
CID 46735889
5-[(2-methylquinolin-4-yl)methyl]pyrimidine-2,4-diamine;dihydrochloride
CID 70525377

Frequently Asked Questions

What is the IUPAC name of (2-methylquinolin-4-yl)methanamine;dihydrochloride?
The IUPAC name of (2-methylquinolin-4-yl)methanamine;dihydrochloride (CID 42946478) is (2-methylquinolin-4-yl)methanamine;dihydrochloride.
What is the SMILES notation for (2-methylquinolin-4-yl)methanamine;dihydrochloride?
The canonical SMILES for (2-methylquinolin-4-yl)methanamine;dihydrochloride is Cc1cc(CN)c2ccccc2n1.Cl.Cl.
What is the InChIKey of (2-methylquinolin-4-yl)methanamine;dihydrochloride?
The InChIKey is AVAORVCXKGFCCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2.2ClH/c1-8-6-9(7-12)10-4-2-3-5-11(10)13-8;;/h2-6H,7,12H2,1H3;2*1H.
What are the key properties of (2-methylquinolin-4-yl)methanamine;dihydrochloride?
(2-methylquinolin-4-yl)methanamine;dihydrochloride has a molecular weight of 245.15 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylquinolin-4-yl)methanamine;dihydrochloride is sourced from PubChem (CID 42946478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).