2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine

C15H16N4 — CID 55154213

IUPAC2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine
SMILESCc1ccc2cccc(NCc3nc[nH]c3C)c2n1
InChIInChI=1S/C15H16N4/c1-10-6-7-12-4-3-5-13(15(12)19-10)16-8-14-11(2)17-9-18-14/h3-7,9,16H,8H2,1-2H3,(H,17,18)
InChIKeyYWYONVSKXBHWBF-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.19
Rot. Bonds3

About 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine

2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine (PubChem CID 55154213) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine.

Molecular Properties

Compound Name2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine
PubChem CID55154213
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine
SMILESCc1ccc2cccc(NCc3nc[nH]c3C)c2n1
InChIInChI=1S/C15H16N4/c1-10-6-7-12-4-3-5-13(15(12)19-10)16-8-14-11(2)17-9-18-14/h3-7,9,16H,8H2,1-2H3,(H,17,18)
InChIKeyYWYONVSKXBHWBF-UHFFFAOYSA-N
XLogP3.19
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-difluoro-N-[(5-methyl-1H-imidazol-4-yl)methyl]aniline
CID 62741383
3-chloro-2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]aniline
CID 62747617
N-[(2,6-difluorophenyl)methyl]-2-methylquinolin-8-amine
CID 62954438
2-methyl-N-[(2-methylphenyl)methyl]quinolin-8-amine
CID 62954281
N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-pyrazol-1-ylaniline
CID 55114545
5-chloro-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine
CID 62741375
N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine
CID 62954974
N-[(4-bromo-3-methylphenyl)methyl]-2-methylquinolin-8-amine
CID 66473623
(2-methylquinolin-8-yl)hydrazine
CID 957615
3-chloro-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-pyrazol-1-ylaniline
CID 62742484
N-[(4,5-dibromothiophen-2-yl)methyl]-2-methylquinolin-8-amine
CID 102835610
N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 62749408

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine?
The IUPAC name of 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine (CID 55154213) is 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine.
What is the SMILES notation for 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine?
The canonical SMILES for 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine is Cc1ccc2cccc(NCc3nc[nH]c3C)c2n1.
What is the InChIKey of 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine?
The InChIKey is YWYONVSKXBHWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-10-6-7-12-4-3-5-13(15(12)19-10)16-8-14-11(2)17-9-18-14/h3-7,9,16H,8H2,1-2H3,(H,17,18).
What are the key properties of 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine?
2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine has a molecular weight of 252.32 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-8-amine is sourced from PubChem (CID 55154213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).