[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate

C14H18N2O5 — CID 7717562

IUPAC[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate
SMILESO=C(COC(=O)C1CCCC1)NC(=O)NCc1ccco1
InChIInChI=1S/C14H18N2O5/c17-12(9-21-13(18)10-4-1-2-5-10)16-14(19)15-8-11-6-3-7-20-11/h3,6-7,10H,1-2,4-5,8-9H2,(H2,15,16,17,19)
InChIKeyFIQUXQKENYCSTM-UHFFFAOYSA-N
MW294.31 g/mol
LogP1.34
Rot. Bonds5

About [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate

[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate (PubChem CID 7717562) has the molecular formula C14H18N2O5 and a molecular weight of 294.31 g/mol. Its IUPAC name is [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate.

Molecular Properties

Compound Name[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate
PubChem CID7717562
Molecular FormulaC14H18N2O5
Molecular Weight294.31 g/mol
Exact Mass294.12
IUPAC Name[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate
SMILESO=C(COC(=O)C1CCCC1)NC(=O)NCc1ccco1
InChIInChI=1S/C14H18N2O5/c17-12(9-21-13(18)10-4-1-2-5-10)16-14(19)15-8-11-6-3-7-20-11/h3,6-7,10H,1-2,4-5,8-9H2,(H2,15,16,17,19)
InChIKeyFIQUXQKENYCSTM-UHFFFAOYSA-N
XLogP1.34
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] (1R,5R)-9-oxobicyclo[3.3.1]nonane-3-carboxylate
CID 50937596
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] furan-2-carboxylate
CID 2631632
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] (2S)-2-[(3aR,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propanoate
CID 7572726
1-(cyclopentylmethyl)-3-(furan-2-ylmethyl)urea
CID 47172133
ethyl (3R)-1-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]piperidine-3-carboxylate
CID 8531993
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] (3R)-5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxylate
CID 7898555
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanylacetate
CID 7739268
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2,6-dichlorobenzoate
CID 2488908
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate
CID 46794326
4-O-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 1-O-methyl benzene-1,4-dicarboxylate
CID 9116888
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 2590459
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate
CID 7791464

Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate?
The IUPAC name of [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate (CID 7717562) is [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate.
What is the SMILES notation for [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate?
The canonical SMILES for [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate is O=C(COC(=O)C1CCCC1)NC(=O)NCc1ccco1.
What is the InChIKey of [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate?
The InChIKey is FIQUXQKENYCSTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O5/c17-12(9-21-13(18)10-4-1-2-5-10)16-14(19)15-8-11-6-3-7-20-11/h3,6-7,10H,1-2,4-5,8-9H2,(H2,15,16,17,19).
What are the key properties of [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate?
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate has a molecular weight of 294.31 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] cyclopentanecarboxylate is sourced from PubChem (CID 7717562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).