2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one

C23H18N2O4 — CID 32534624

IUPAC2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(C(=O)N3CCN(C(=O)c4ccoc4)CC3)cc21
InChIInChI=1S/C23H18N2O4/c26-21-19-4-2-1-3-17(19)18-6-5-15(13-20(18)21)22(27)24-8-10-25(11-9-24)23(28)16-7-12-29-14-16/h1-7,12-14H,8-11H2
InChIKeyKYXSRKMSFFSTNK-UHFFFAOYSA-N
MW386.41 g/mol
LogP3.09
Rot. Bonds2

About 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one

2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one (PubChem CID 32534624) has the molecular formula C23H18N2O4 and a molecular weight of 386.41 g/mol. Its IUPAC name is 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one.

Molecular Properties

Compound Name2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one
PubChem CID32534624
Molecular FormulaC23H18N2O4
Molecular Weight386.41 g/mol
Exact Mass386.13
IUPAC Name2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(C(=O)N3CCN(C(=O)c4ccoc4)CC3)cc21
InChIInChI=1S/C23H18N2O4/c26-21-19-4-2-1-3-17(19)18-6-5-15(13-20(18)21)22(27)24-8-10-25(11-9-24)23(28)16-7-12-29-14-16/h1-7,12-14H,8-11H2
InChIKeyKYXSRKMSFFSTNK-UHFFFAOYSA-N
XLogP3.09
TPSA70.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,1-dioxo-1,4-thiazinane-4-carbonyl)anthracene-9,10-dione
CID 169240438
2-(4-hydroxypiperidine-1-carbonyl)fluoren-9-one
CID 110883962
ethyl 4-(9-oxofluorene-2-carbonyl)piperazine-1-carboxylate
CID 17446072
2-[4-(2,3-dichlorobenzoyl)piperazine-1-carbonyl]fluoren-9-one
CID 55800240
1-[2-oxo-2-[4-(9-oxofluorene-2-carbonyl)piperazin-1-yl]ethyl]pyrrolidine-2,5-dione
CID 55950727
[4-(9,10-dioxoanthracene-2-carbonyl)piperazin-1-yl]methanesulfinate
CID 170189766
2-(4-phenylpiperidine-1-carbonyl)anthracene-9,10-dione
CID 633858
1-[4-(9,10-dioxoanthracene-2-carbonyl)piperazin-1-yl]cyclopropane-1-sulfinic acid
CID 170189844
(3,4-dichlorophenyl)-[4-(furan-3-carbonyl)piperazin-1-yl]methanone
CID 32530613
2-(4-butylsulfanylpiperazine-1-carbonyl)anthracene-9,10-dione
CID 169240449
[4-(furan-3-carbonyl)piperazin-1-yl]-(3-pyrrol-1-ylphenyl)methanone
CID 32532603
1-(9,10-dioxoanthracene-2-carbonyl)-N,N-dimethylpiperidine-4-sulfonamide
CID 175949360

Frequently Asked Questions

What is the IUPAC name of 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one?
The IUPAC name of 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one (CID 32534624) is 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one.
What is the SMILES notation for 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one?
The canonical SMILES for 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one is O=C1c2ccccc2-c2ccc(C(=O)N3CCN(C(=O)c4ccoc4)CC3)cc21.
What is the InChIKey of 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one?
The InChIKey is KYXSRKMSFFSTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O4/c26-21-19-4-2-1-3-17(19)18-6-5-15(13-20(18)21)22(27)24-8-10-25(11-9-24)23(28)16-7-12-29-14-16/h1-7,12-14H,8-11H2.
What are the key properties of 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one?
2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one has a molecular weight of 386.41 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(furan-3-carbonyl)piperazine-1-carbonyl]fluoren-9-one is sourced from PubChem (CID 32534624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).