N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide

C19H21N3O5 — CID 17468809

IUPACN-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC(=O)CN2CCN(C(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C19H21N3O5/c1-26-15-6-4-14(5-7-15)18(24)20-17(23)13-21-8-10-22(11-9-21)19(25)16-3-2-12-27-16/h2-7,12H,8-11,13H2,1H3,(H,20,23,24)
InChIKeyGFWQCRMDEXABEL-UHFFFAOYSA-N
MW371.39 g/mol
LogP1.00
Rot. Bonds5

About N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide

N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide (PubChem CID 17468809) has the molecular formula C19H21N3O5 and a molecular weight of 371.39 g/mol. Its IUPAC name is N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide
PubChem CID17468809
Molecular FormulaC19H21N3O5
Molecular Weight371.39 g/mol
Exact Mass371.15
IUPAC NameN-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC(=O)CN2CCN(C(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C19H21N3O5/c1-26-15-6-4-14(5-7-15)18(24)20-17(23)13-21-8-10-22(11-9-21)19(25)16-3-2-12-27-16/h2-7,12H,8-11,13H2,1H3,(H,20,23,24)
InChIKeyGFWQCRMDEXABEL-UHFFFAOYSA-N
XLogP1.00
TPSA92.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.39
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 37375142
furan-2-yl-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone
CID 648203
N-[2-[[C-[4-(furan-2-carbonyl)piperazin-1-yl]-N-methylcarbonimidoyl]amino]ethyl]-4-methoxybenzamide;hydroiodide
CID 111166344
N'-acetyl-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetohydrazide
CID 8548952
furan-2-yl-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methanone
CID 56810704
N-tert-butyl-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide
CID 26495641
2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 35148049
dimethyl 2-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]amino]benzene-1,4-dicarboxylate
CID 2414666
N-[(1R)-1-(benzenesulfonyl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]-4-methoxybenzamide
CID 51858044
furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
CID 113073228
3-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]amino]-N-methylbenzamide
CID 8549513
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-phenylacetamide
CID 773151

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide?
The IUPAC name of N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide (CID 17468809) is N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide.
What is the SMILES notation for N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide?
The canonical SMILES for N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide is COc1ccc(C(=O)NC(=O)CN2CCN(C(=O)c3ccco3)CC2)cc1.
What is the InChIKey of N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide?
The InChIKey is GFWQCRMDEXABEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O5/c1-26-15-6-4-14(5-7-15)18(24)20-17(23)13-21-8-10-22(11-9-21)19(25)16-3-2-12-27-16/h2-7,12H,8-11,13H2,1H3,(H,20,23,24).
What are the key properties of N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide?
N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide has a molecular weight of 371.39 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide is sourced from PubChem (CID 17468809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).