6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one

C14H19N3O — CID 82294809

IUPAC6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCN1CCNCC1c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H19N3O/c1-17-7-6-15-9-13(17)11-2-4-12-10(8-11)3-5-14(18)16-12/h2,4,8,13,15H,3,5-7,9H2,1H3,(H,16,18)
InChIKeyVFSUAHVXFQRXTM-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.15
Rot. Bonds1

About 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one

6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 82294809) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID82294809
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCN1CCNCC1c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H19N3O/c1-17-7-6-15-9-13(17)11-2-4-12-10(8-11)3-5-14(18)16-12/h2,4,8,13,15H,3,5-7,9H2,1H3,(H,16,18)
InChIKeyVFSUAHVXFQRXTM-UHFFFAOYSA-N
XLogP1.15
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(aziridin-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 82468625
6-morpholin-2-yl-3,4-dihydro-1H-quinolin-2-one
CID 82289623
6-[2-(1-methylpyrazol-4-yl)piperazine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 154762702
6-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 170310883
6-(1,3-oxazolidin-5-yl)-3,4-dihydro-1H-quinolin-2-one
CID 82472049
6-[(2R)-oxiran-2-yl]-3,4-dihydro-1H-quinolin-2-one
CID 95436529
2-(1,3-benzodioxol-5-yl)-1-methylpiperazine
CID 70977935
6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 164753190
6-[(pyrrolidin-3-ylamino)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 115118827
1-methyl-2-(4-propan-2-ylphenyl)piperazine
CID 82021257
2-(3-chloro-4-propan-2-yloxyphenyl)-1-methylpiperazine
CID 82305373
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methylpiperazine
CID 82086895

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one (CID 82294809) is 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one is CN1CCNCC1c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is VFSUAHVXFQRXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-17-7-6-15-9-13(17)11-2-4-12-10(8-11)3-5-14(18)16-12/h2,4,8,13,15H,3,5-7,9H2,1H3,(H,16,18).
What are the key properties of 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 245.33 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpiperazin-2-yl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 82294809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).