4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline

C18H20N4 — CID 133448347

IUPAC4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline
SMILESCc1cc(N2CCCC(c3ncc[nH]3)C2)c2ccccc2n1
InChIInChI=1S/C18H20N4/c1-13-11-17(15-6-2-3-7-16(15)21-13)22-10-4-5-14(12-22)18-19-8-9-20-18/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H,19,20)
InChIKeyRXXWJGXNLPHSLF-UHFFFAOYSA-N
MW292.39 g/mol
LogP3.65
Rot. Bonds2

About 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline

4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline (PubChem CID 133448347) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline.

Molecular Properties

Compound Name4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline
PubChem CID133448347
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline
SMILESCc1cc(N2CCCC(c3ncc[nH]3)C2)c2ccccc2n1
InChIInChI=1S/C18H20N4/c1-13-11-17(15-6-2-3-7-16(15)21-13)22-10-4-5-14(12-22)18-19-8-9-20-18/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H,19,20)
InChIKeyRXXWJGXNLPHSLF-UHFFFAOYSA-N
XLogP3.65
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(1H-imidazol-2-yl)piperidin-1-yl]-3-piperidin-1-ylquinoxaline
CID 127741692
N,N-dimethyl-2-[2-[(3S)-1-(2-methylquinolin-4-yl)piperidin-3-yl]imidazol-1-yl]ethanamine
CID 97189808
N,N-dimethyl-3-[2-[1-(2-methylquinolin-4-yl)piperidin-3-yl]imidazol-1-yl]propan-1-amine
CID 72838131
cyclobutanecarboxylic acid;2-methyl-4-pyrrolidin-1-ylquinoline
CID 158504598
methyl 1-(2-methylquinolin-4-yl)piperidine-3-carboxylate
CID 115538397
2-[2-[3-(1H-imidazol-2-yl)piperidin-1-yl]benzimidazol-1-yl]ethanol
CID 72881394
4-(3-bromo-4-methylpiperidin-1-yl)-2-methylquinoline
CID 102961080
4-chloro-5-ethyl-6-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-phenylpyrimidine
CID 133448375
2-[3-(1H-imidazol-2-yl)piperidin-1-yl]-5-methyl-1,3,4-thiadiazole
CID 133448356
2-methyl-4-piperazin-1-ylquinoline;hydrochloride
CID 17040066
3-[[(3R)-3-(1H-imidazol-2-yl)piperidin-1-yl]methyl]-2-methoxyquinoline
CID 97155322
4-[2-(chloromethyl)pyrrolidin-1-yl]-2-methylquinoline
CID 55184612

Frequently Asked Questions

What is the IUPAC name of 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline?
The IUPAC name of 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline (CID 133448347) is 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline.
What is the SMILES notation for 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline?
The canonical SMILES for 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline is Cc1cc(N2CCCC(c3ncc[nH]3)C2)c2ccccc2n1.
What is the InChIKey of 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline?
The InChIKey is RXXWJGXNLPHSLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4/c1-13-11-17(15-6-2-3-7-16(15)21-13)22-10-4-5-14(12-22)18-19-8-9-20-18/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H,19,20).
What are the key properties of 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline?
4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline has a molecular weight of 292.39 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1H-imidazol-2-yl)piperidin-1-yl]-2-methylquinoline is sourced from PubChem (CID 133448347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).