4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline

C21H24N4 — CID 70726995

IUPAC4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
SMILESc1ccc2c(N3CCCC(c4nccn4CC4CC4)C3)ccnc2c1
InChIInChI=1S/C21H24N4/c1-2-6-19-18(5-1)20(9-10-22-19)24-12-3-4-17(15-24)21-23-11-13-25(21)14-16-7-8-16/h1-2,5-6,9-11,13,16-17H,3-4,7-8,12,14-15H2
InChIKeyMSYSQNVXCJKLRE-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.23
Rot. Bonds4

About 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline

4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline (PubChem CID 70726995) has the molecular formula C21H24N4 and a molecular weight of 332.45 g/mol. Its IUPAC name is 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline.

Molecular Properties

Compound Name4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
PubChem CID70726995
Molecular FormulaC21H24N4
Molecular Weight332.45 g/mol
Exact Mass332.20
IUPAC Name4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
SMILESc1ccc2c(N3CCCC(c4nccn4CC4CC4)C3)ccnc2c1
InChIInChI=1S/C21H24N4/c1-2-6-19-18(5-1)20(9-10-22-19)24-12-3-4-17(15-24)21-23-11-13-25(21)14-16-7-8-16/h1-2,5-6,9-11,13,16-17H,3-4,7-8,12,14-15H2
InChIKeyMSYSQNVXCJKLRE-UHFFFAOYSA-N
XLogP4.23
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3R)-3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 96574055
N,N-dimethyl-2-[2-(1-quinolin-4-ylpiperidin-3-yl)imidazol-1-yl]ethanamine
CID 72863111
4-[(3S)-3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 97155167
3-(1-quinolin-4-ylpiperidin-3-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CID 75370498
3-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-6-methylpyridazine
CID 70738565
6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 97284997
N,N-dimethyl-2-[2-[(3S)-1-(2-methylquinolin-4-yl)piperidin-3-yl]imidazol-1-yl]ethanamine
CID 97189808
4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 70734824
2-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-5-methoxypyrimidine
CID 70777559
N,N-dimethyl-3-[2-[1-(2-methylquinolin-4-yl)piperidin-3-yl]imidazol-1-yl]propan-1-amine
CID 72838131
3-[1-(cyclopropylmethyl)imidazol-2-yl]-1-[(2-pyrazol-1-ylphenyl)methyl]piperidine
CID 70726892
[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-quinolin-3-ylmethanone
CID 70781771

Frequently Asked Questions

What is the IUPAC name of 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
The IUPAC name of 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline (CID 70726995) is 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline.
What is the SMILES notation for 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
The canonical SMILES for 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline is c1ccc2c(N3CCCC(c4nccn4CC4CC4)C3)ccnc2c1.
What is the InChIKey of 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
The InChIKey is MSYSQNVXCJKLRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4/c1-2-6-19-18(5-1)20(9-10-22-19)24-12-3-4-17(15-24)21-23-11-13-25(21)14-16-7-8-16/h1-2,5-6,9-11,13,16-17H,3-4,7-8,12,14-15H2.
What are the key properties of 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline has a molecular weight of 332.45 g/mol, XLogP of 4.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline is sourced from PubChem (CID 70726995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).