1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole

C20H24N4 — CID 56852643

IUPAC1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole
SMILESCCCN1CCC(n2c(-c3ccccn3)nc3ccccc32)CC1
InChIInChI=1S/C20H24N4/c1-2-13-23-14-10-16(11-15-23)24-19-9-4-3-7-17(19)22-20(24)18-8-5-6-12-21-18/h3-9,12,16H,2,10-11,13-15H2,1H3
InChIKeyIUCKFNZAQMXXAZ-UHFFFAOYSA-N
MW320.44 g/mol
LogP4.15
Rot. Bonds4

About 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole

1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole (PubChem CID 56852643) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole.

Molecular Properties

Compound Name1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole
PubChem CID56852643
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC Name1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole
SMILESCCCN1CCC(n2c(-c3ccccn3)nc3ccccc32)CC1
InChIInChI=1S/C20H24N4/c1-2-13-23-14-10-16(11-15-23)24-19-9-4-3-7-17(19)22-20(24)18-8-5-6-12-21-18/h3-9,12,16H,2,10-11,13-15H2,1H3
InChIKeyIUCKFNZAQMXXAZ-UHFFFAOYSA-N
XLogP4.15
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(methoxymethyl)furan-2-yl]-[4-(2-pyridin-2-ylbenzimidazol-1-yl)piperidin-1-yl]methanone
CID 42479444
2-[(4-methoxyphenyl)methyl]-1-(1-propylpiperidin-4-yl)benzimidazole
CID 26345971
ethyl 4-(2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate
CID 21050439
1-cyclohexyl-2-[6-(1-cyclohexylbenzimidazol-2-yl)-2-pyridinyl]benzimidazole;vanadium;trichloride
CID 173243403
1-(1-benzylpiperidin-4-yl)-2-methylbenzimidazole
CID 21193036
[1-[(2-amino-4-pyridinyl)methyl]piperidin-4-yl]-[4-(5-methyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidin-1-yl]methanone
CID 71068471
[4-(5-methylsulfonyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidin-1-yl]-[1-(pyridazin-4-ylmethyl)piperidin-4-yl]methanone
CID 21050345
2-pyridin-2-yl-1-[2,4,6-trimethyl-3,5-bis(2-pyridin-2-ylbenzimidazol-1-yl)phenyl]benzimidazole
CID 89180674
ethyl 4-(6-chloro-2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate
CID 59360883
CID 91316834
CID 91316834
1-[1-[3-(4-iodophenyl)-3-phenylpropyl]piperidin-4-yl]-2-methylbenzimidazole
CID 58282556
3-(1-ethylpiperidin-4-yl)-2-pyridin-3-ylimidazo[4,5-b]pyridine
CID 117164679

Frequently Asked Questions

What is the IUPAC name of 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole?
The IUPAC name of 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole (CID 56852643) is 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole.
What is the SMILES notation for 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole?
The canonical SMILES for 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole is CCCN1CCC(n2c(-c3ccccn3)nc3ccccc32)CC1.
What is the InChIKey of 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole?
The InChIKey is IUCKFNZAQMXXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4/c1-2-13-23-14-10-16(11-15-23)24-19-9-4-3-7-17(19)22-20(24)18-8-5-6-12-21-18/h3-9,12,16H,2,10-11,13-15H2,1H3.
What are the key properties of 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole?
1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole has a molecular weight of 320.44 g/mol, XLogP of 4.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propylpiperidin-4-yl)-2-pyridin-2-ylbenzimidazole is sourced from PubChem (CID 56852643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).