furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone

C16H24N2O3 — CID 110905169

IUPACfuran-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone
SMILESO=C(c1ccoc1)N1CCN(CC2(O)CCCCC2)CC1
InChIInChI=1S/C16H24N2O3/c19-15(14-4-11-21-12-14)18-9-7-17(8-10-18)13-16(20)5-2-1-3-6-16/h4,11-12,20H,1-3,5-10,13H2
InChIKeyZMAXNZKIZXQPOX-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.73
Rot. Bonds3

About furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone

furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone (PubChem CID 110905169) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone
PubChem CID110905169
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Namefuran-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone
SMILESO=C(c1ccoc1)N1CCN(CC2(O)CCCCC2)CC1
InChIInChI=1S/C16H24N2O3/c19-15(14-4-11-21-12-14)18-9-7-17(8-10-18)13-16(20)5-2-1-3-6-16/h4,11-12,20H,1-3,5-10,13H2
InChIKeyZMAXNZKIZXQPOX-UHFFFAOYSA-N
XLogP1.73
TPSA56.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

furan-3-yl-[4-[[3-(hydroxymethyl)oxetan-3-yl]methyl]piperazin-1-yl]methanone
CID 111976736
1-(furan-3-carbonyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
CID 111445987
2-[4-(furan-3-carbonyl)-1,4-diazepan-1-yl]-1-morpholin-4-ylethanone
CID 129368099
4-ethyl-1-(furan-3-carbonyl)piperidine-4-carboxylic acid
CID 63124826
furan-3-yl-[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]methanone
CID 84592483
3-[2-[4-(furan-3-carbonyl)piperazin-1-yl]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 34955514
N-[(1-hydroxycyclopentyl)methyl]-N-methylfuran-3-carboxamide
CID 115760185
[4-[(5-bromofuran-2-yl)methyl]piperazin-1-yl]-(furan-3-yl)methanone
CID 99791992
furan-3-yl-[4-(6-piperidin-1-ylpyridazin-3-yl)piperazin-1-yl]methanone
CID 122334677
furan-3-yl-(1-hydroxycycloheptyl)methanone
CID 103450360
1-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]-2-pyrrolidin-1-ylethanone
CID 110932660
tert-butyl 4-[(1-hydroxycyclohexyl)methyl]piperazine-1-carboxylate
CID 115750820

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone?
The IUPAC name of furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone (CID 110905169) is furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone.
What is the SMILES notation for furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone?
The canonical SMILES for furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone is O=C(c1ccoc1)N1CCN(CC2(O)CCCCC2)CC1.
What is the InChIKey of furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone?
The InChIKey is ZMAXNZKIZXQPOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c19-15(14-4-11-21-12-14)18-9-7-17(8-10-18)13-16(20)5-2-1-3-6-16/h4,11-12,20H,1-3,5-10,13H2.
What are the key properties of furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone?
furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone has a molecular weight of 292.38 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]methanone is sourced from PubChem (CID 110905169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).