(4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone

C19H18N4O — CID 3691532

IUPAC(4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone
SMILESO=C(c1ccc2ccccc2n1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C19H18N4O/c24-19(17-9-8-15-5-1-2-6-16(15)21-17)23-13-11-22(12-14-23)18-7-3-4-10-20-18/h1-10H,11-14H2
InChIKeyHAWZVWGQLNELBP-UHFFFAOYSA-N
MW318.38 g/mol
LogP2.59
Rot. Bonds2

About (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone

(4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone (PubChem CID 3691532) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone.

Molecular Properties

Compound Name(4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone
PubChem CID3691532
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name(4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone
SMILESO=C(c1ccc2ccccc2n1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C19H18N4O/c24-19(17-9-8-15-5-1-2-6-16(15)21-17)23-13-11-22(12-14-23)18-7-3-4-10-20-18/h1-10H,11-14H2
InChIKeyHAWZVWGQLNELBP-UHFFFAOYSA-N
XLogP2.59
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]-quinolin-2-ylmethanone
CID 122336357
[4-(6-pyrrol-1-ylpyrimidin-4-yl)piperazin-1-yl]-quinolin-2-ylmethanone
CID 122341955
azepan-1-yl(quinolin-2-yl)methanone
CID 7779308
(4-pyridin-1-ium-4-ylpiperazin-1-yl)-quinolin-2-ylmethanone
CID 9228414
(2-piperidin-1-ylpyrimidin-4-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 109298280
pyrazin-2-yl-(4-quinolin-2-ylpiperazin-1-yl)methanone
CID 108741613
[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-quinolin-2-ylmethanone
CID 122279259
(8-phenyl-1,6-naphthyridin-2-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 3378385
1-(quinoline-2-carbonyl)piperidin-4-one
CID 2556285
piperidin-1-yl-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]methanone
CID 109298462
(2-anilinopyrimidin-4-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 109310580
[4-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]piperazin-1-yl]-quinolin-2-ylmethanone
CID 90491240

Frequently Asked Questions

What is the IUPAC name of (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone?
The IUPAC name of (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone (CID 3691532) is (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone.
What is the SMILES notation for (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone?
The canonical SMILES for (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone is O=C(c1ccc2ccccc2n1)N1CCN(c2ccccn2)CC1.
What is the InChIKey of (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone?
The InChIKey is HAWZVWGQLNELBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c24-19(17-9-8-15-5-1-2-6-16(15)21-17)23-13-11-22(12-14-23)18-7-3-4-10-20-18/h1-10H,11-14H2.
What are the key properties of (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone?
(4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone has a molecular weight of 318.38 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pyridin-2-ylpiperazin-1-yl)-quinolin-2-ylmethanone is sourced from PubChem (CID 3691532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).