2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline

C15H15N3 — CID 78995513

IUPAC2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline
SMILESCc1cc(Cn2ccnc2C)c2ccccc2n1
InChIInChI=1S/C15H15N3/c1-11-9-13(10-18-8-7-16-12(18)2)14-5-3-4-6-15(14)17-11/h3-9H,10H2,1-2H3
InChIKeyIQBFZBNEDPOZDY-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.10
Rot. Bonds2

About 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline

2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline (PubChem CID 78995513) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline.

Molecular Properties

Compound Name2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline
PubChem CID78995513
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline
SMILESCc1cc(Cn2ccnc2C)c2ccccc2n1
InChIInChI=1S/C15H15N3/c1-11-9-13(10-18-8-7-16-12(18)2)14-5-3-4-6-15(14)17-11/h3-9H,10H2,1-2H3
InChIKeyIQBFZBNEDPOZDY-UHFFFAOYSA-N
XLogP3.10
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-methylimidazol-1-yl)methyl]quinolin-2-amine
CID 62209706
3-amino-1-[(2-methylquinolin-4-yl)methyl]pyridin-2-one
CID 79235474
2-[1-[(2-methylquinolin-4-yl)methyl]pyrrol-2-yl]ethanamine
CID 79240135
1-benzyl-2-methylimidazole
CID 158634472
2-(2-methylquinolin-4-yl)acetic acid
CID 79019861
1-[(2-methylquinolin-4-yl)methyl]-1,2,4-triazol-3-amine
CID 79235165
N-[[1-[(2-methylquinolin-4-yl)methyl]pyrrol-2-yl]methyl]ethanamine
CID 79231737
(2-methylquinolin-4-yl)methanethiol
CID 79885955
5-bromo-1-[(2-methylquinolin-4-yl)methyl]pyrrole-3-carboxylic acid
CID 79231432
(2-methylquinolin-4-yl)methanamine;dihydrochloride
CID 42946478
2-methyl-4-(2-methylbut-2-enyl)quinoline
CID 123480246
5-bromo-1-[(2-methylquinolin-4-yl)methyl]pyrimidine-2,4-dione
CID 79231970

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline?
The IUPAC name of 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline (CID 78995513) is 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline.
What is the SMILES notation for 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline?
The canonical SMILES for 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline is Cc1cc(Cn2ccnc2C)c2ccccc2n1.
What is the InChIKey of 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline?
The InChIKey is IQBFZBNEDPOZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-11-9-13(10-18-8-7-16-12(18)2)14-5-3-4-6-15(14)17-11/h3-9H,10H2,1-2H3.
What are the key properties of 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline?
2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline has a molecular weight of 237.31 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline is sourced from PubChem (CID 78995513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).