furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone

C19H22N2O3 — CID 22375412

IUPACfuran-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone
SMILESCOc1ccc2c(c1)C(N1CCN(C(=O)c3ccoc3)CC1)CC2
InChIInChI=1S/C19H22N2O3/c1-23-16-4-2-14-3-5-18(17(14)12-16)20-7-9-21(10-8-20)19(22)15-6-11-24-13-15/h2,4,6,11-13,18H,3,5,7-10H2,1H3
InChIKeyZLYYEWGQHHURSP-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.73
Rot. Bonds3

About furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone

furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone (PubChem CID 22375412) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone
PubChem CID22375412
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Namefuran-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone
SMILESCOc1ccc2c(c1)C(N1CCN(C(=O)c3ccoc3)CC1)CC2
InChIInChI=1S/C19H22N2O3/c1-23-16-4-2-14-3-5-18(17(14)12-16)20-7-9-21(10-8-20)19(22)15-6-11-24-13-15/h2,4,6,11-13,18H,3,5,7-10H2,1H3
InChIKeyZLYYEWGQHHURSP-UHFFFAOYSA-N
XLogP2.73
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone with MolForge

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Related Compounds

1-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]butane-1,2-dione
CID 22375405
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)azetidine-3-carboxylic acid
CID 79368867
(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-(furan-3-yl)methanone
CID 56819357
[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-(furan-3-yl)methanone
CID 37279771
1-[4-(furan-3-carbonyl)piperazin-1-yl]-2-(3-methoxyphenyl)ethanone
CID 32531628
N-(2,5-dimethoxyphenyl)-4-(furan-3-carbonyl)-1,4-diazepane-1-carboxamide
CID 72912569
N-[1-(furan-3-carbonyl)piperidin-4-yl]-3-methoxybenzamide
CID 38022754
10-methoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
CID 23333695
N-[1-(2,5-dimethoxyphenyl)ethyl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 55566682
[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-(1-methylcyclohexyl)methanone;1-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]undec-10-en-1-one
CID 67656374
1-(furan-3-carbonyl)-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 35676446
1-[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-3-(3-methoxyphenyl)propan-1-one
CID 110399850

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone?
The IUPAC name of furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone (CID 22375412) is furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone.
What is the SMILES notation for furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone?
The canonical SMILES for furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone is COc1ccc2c(c1)C(N1CCN(C(=O)c3ccoc3)CC1)CC2.
What is the InChIKey of furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone?
The InChIKey is ZLYYEWGQHHURSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-23-16-4-2-14-3-5-18(17(14)12-16)20-7-9-21(10-8-20)19(22)15-6-11-24-13-15/h2,4,6,11-13,18H,3,5,7-10H2,1H3.
What are the key properties of furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone?
furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone has a molecular weight of 326.40 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[4-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 22375412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).