(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine

C13H12N4 — CID 63222608

IUPAC(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine
SMILESNCc1cnc(-c2ccc3ccccc3n2)[nH]1
InChIInChI=1S/C13H12N4/c14-7-10-8-15-13(16-10)12-6-5-9-3-1-2-4-11(9)17-12/h1-6,8H,7,14H2,(H,15,16)
InChIKeyBLHBMSQXPNMCKY-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.08
Rot. Bonds2

About (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine

(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine (PubChem CID 63222608) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine.

Molecular Properties

Compound Name(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine
PubChem CID63222608
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC Name(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine
SMILESNCc1cnc(-c2ccc3ccccc3n2)[nH]1
InChIInChI=1S/C13H12N4/c14-7-10-8-15-13(16-10)12-6-5-9-3-1-2-4-11(9)17-12/h1-6,8H,7,14H2,(H,15,16)
InChIKeyBLHBMSQXPNMCKY-UHFFFAOYSA-N
XLogP2.08
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1H-benzimidazol-2-yl)quinoline
CID 646533
[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine
CID 63108798
8-quinolin-2-yl-7H-purin-6-amine
CID 114608266
(3-quinolin-2-yl-1H-1,2,4-triazol-5-yl)methanamine
CID 55163117
2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline
CID 18470716
5-quinolin-2-ylpyrimidin-2-amine
CID 112694944
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294
[2-(aminomethyl)-1H-imidazol-5-yl]methanamine
CID 54546826
5-bromo-4-hydroxy-2-quinolin-2-yl-1H-pyrimidin-6-one
CID 66284746
2-(4-quinolin-2-yl-1H-pyrrol-3-yl)quinoline
CID 54524072
2-quinolin-2-yl-3H-benzimidazole-5-carbonitrile
CID 79004134
iridium;tris(2-phenylquinoline)
CID 122129463

Frequently Asked Questions

What is the IUPAC name of (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine?
The IUPAC name of (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine (CID 63222608) is (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine.
What is the SMILES notation for (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine?
The canonical SMILES for (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine is NCc1cnc(-c2ccc3ccccc3n2)[nH]1.
What is the InChIKey of (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine?
The InChIKey is BLHBMSQXPNMCKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4/c14-7-10-8-15-13(16-10)12-6-5-9-3-1-2-4-11(9)17-12/h1-6,8H,7,14H2,(H,15,16).
What are the key properties of (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine?
(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine has a molecular weight of 224.27 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-quinolin-2-yl-1H-imidazol-5-yl)methanamine is sourced from PubChem (CID 63222608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).