6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one

C19H18N4O2 — CID 13317106

IUPAC6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one
SMILESO=C(c1cccnc1)N1CCN(c2ccc3[nH]c(=O)ccc3c2)CC1
InChIInChI=1S/C19H18N4O2/c24-18-6-3-14-12-16(4-5-17(14)21-18)22-8-10-23(11-9-22)19(25)15-2-1-7-20-13-15/h1-7,12-13H,8-11H2,(H,21,24)
InChIKeyHVAZJGXPPBQNJP-UHFFFAOYSA-N
MW334.38 g/mol
LogP1.89
Rot. Bonds2

About 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one

6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one (PubChem CID 13317106) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one
PubChem CID13317106
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one
SMILESO=C(c1cccnc1)N1CCN(c2ccc3[nH]c(=O)ccc3c2)CC1
InChIInChI=1S/C19H18N4O2/c24-18-6-3-14-12-16(4-5-17(14)21-18)22-8-10-23(11-9-22)19(25)15-2-1-7-20-13-15/h1-7,12-13H,8-11H2,(H,21,24)
InChIKeyHVAZJGXPPBQNJP-UHFFFAOYSA-N
XLogP1.89
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 113076863
[4-(6-amino-3-pyridinyl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 43461900
6-[4-(pyridine-3-carbonyl)piperazine-1-carbonyl]-3H-1,3-benzoxazol-2-one
CID 110400153
4-(2-oxo-1H-quinolin-6-yl)piperazine-1-carbaldehyde
CID 13236362
2-oxo-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]acetic acid
CID 28706038
[3-(1H-indol-2-yl)pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 113088338
N-[3-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]methanesulfonamide
CID 173143971
2,2-dimethyl-1-[4-(pyridine-3-carbonyl)piperazin-1-yl]propan-1-one
CID 84550110
pyridin-3-yl-(4-quinolin-2-ylpiperazin-1-yl)methanone;hydrochloride
CID 3030200
1,3-dimethyl-6-[4-(pyridine-3-carbonyl)piperazin-1-yl]pyrimidine-2,4-dione
CID 53107470
(3,4-dichlorophenyl)-[4-(pyridine-3-carbonyl)piperazin-1-yl]methanone
CID 39565978
[4-(6-piperidin-1-ylpyridazin-3-yl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 122334551

Frequently Asked Questions

What is the IUPAC name of 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one?
The IUPAC name of 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one (CID 13317106) is 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one.
What is the SMILES notation for 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one?
The canonical SMILES for 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one is O=C(c1cccnc1)N1CCN(c2ccc3[nH]c(=O)ccc3c2)CC1.
What is the InChIKey of 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one?
The InChIKey is HVAZJGXPPBQNJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-18-6-3-14-12-16(4-5-17(14)21-18)22-8-10-23(11-9-22)19(25)15-2-1-7-20-13-15/h1-7,12-13H,8-11H2,(H,21,24).
What are the key properties of 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one?
6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one has a molecular weight of 334.38 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1H-quinolin-2-one is sourced from PubChem (CID 13317106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).