(4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone

C14H20N2O2 — CID 717345

IUPAC(4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C14H20N2O2/c17-14(13-6-3-11-18-13)16-9-7-15(8-10-16)12-4-1-2-5-12/h3,6,11-12H,1-2,4-5,7-10H2
InChIKeyZUEMCMNUXHUGTE-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.98
Rot. Bonds2

About (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone

(4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone (PubChem CID 717345) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone.

Molecular Properties

Compound Name(4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone
PubChem CID717345
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name(4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C14H20N2O2/c17-14(13-6-3-11-18-13)16-9-7-15(8-10-16)12-4-1-2-5-12/h3,6,11-12H,1-2,4-5,7-10H2
InChIKeyZUEMCMNUXHUGTE-UHFFFAOYSA-N
XLogP1.98
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Furoyl)piperazine
CID 550206
4-(Furan-2-carbonyl)piperazine-1-carboxamide
CID 762331
4-Acetyl 1-(2-furoyl)piperazine
CID 565340
N-(2-Furoyl)glycine methyl ester
CID 518748
N-[(2S)-3-methyl-1-[[(2S)-4-methyl-1-oxo-1-[[(2S)-1-oxo-3-[(3S)-2-oxopiperidin-3-yl]propan-2-yl]amino]pentan-2-yl]amino]-1-oxobutan-2-yl]furan-2-carboxamide
CID 162515877
(4-Isopropyl-piperazin-1-yl)-(5-piperidin-1-ylmethylfuran-2-yl)-methanone
CID 11244101
1-[4-(Furan-2-carbonyl)piperazin-1-yl]-3-methylbutan-1-one
CID 694979
(4-Benzenesulfonyl-piperazin-1-yl)-furan-2-yl-methanone
CID 719657
N-(1,2,2,6,6-pentamethyl-4-piperidinyl)-2-furamide
CID 723466
1-[(2,2-Dibromo-1-methylcyclopropyl)carbonyl]-4-(2-furoyl)piperazine
CID 3440389
N-[1-cyclohexyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]furan-2-carboxamide
CID 4591666
1-[4-(Furan-2-carbonyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
CID 3158289

Frequently Asked Questions

What is the IUPAC name of (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone?
The IUPAC name of (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone (CID 717345) is (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone.
What is the SMILES notation for (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone?
The canonical SMILES for (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone is O=C(c1ccco1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone?
The InChIKey is ZUEMCMNUXHUGTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c17-14(13-6-3-11-18-13)16-9-7-15(8-10-16)12-4-1-2-5-12/h3,6,11-12H,1-2,4-5,7-10H2.
What are the key properties of (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone?
(4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone has a molecular weight of 248.33 g/mol, XLogP of 1.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopentylpiperazin-1-yl)-(furan-2-yl)methanone is sourced from PubChem (CID 717345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).