[2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate

C20H23NO5 — CID 3220223

IUPAC[2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate
SMILESCOc1ccccc1C(OC(=O)c1ccco1)C(=O)NC1CCCCC1
InChIInChI=1S/C20H23NO5/c1-24-16-11-6-5-10-15(16)18(26-20(23)17-12-7-13-25-17)19(22)21-14-8-3-2-4-9-14/h5-7,10-14,18H,2-4,8-9H2,1H3,(H,21,22)
InChIKeyOSKVZDFARNSMFC-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.64
Rot. Bonds6

About [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate

[2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate (PubChem CID 3220223) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate.

Molecular Properties

Compound Name[2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate
PubChem CID3220223
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name[2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate
SMILESCOc1ccccc1C(OC(=O)c1ccco1)C(=O)NC1CCCCC1
InChIInChI=1S/C20H23NO5/c1-24-16-11-6-5-10-15(16)18(26-20(23)17-12-7-13-25-17)19(22)21-14-8-3-2-4-9-14/h5-7,10-14,18H,2-4,8-9H2,1H3,(H,21,22)
InChIKeyOSKVZDFARNSMFC-UHFFFAOYSA-N
XLogP3.64
TPSA77.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] furan-2-carboxylate
CID 1469985
[2-(cyclohexylamino)-2-oxo-1-pyridin-3-ylethyl] furan-2-carboxylate
CID 43817592
[1-(cyclopentylamino)-1-oxobutan-2-yl] furan-2-carboxylate
CID 3220216
N-[2-(cyclopentylamino)-1-(furan-2-yl)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
CID 23727995
N-[(1S)-2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
CID 25311325
N-cyclooctylfuran-2-carboxamide
CID 790432
N-[2-(cyclopentylamino)-2-oxo-1-pyridin-3-ylethyl]-N-(2-methoxyphenyl)furan-2-carboxamide
CID 647109
N-cyclohexyl-2-(2-methoxyphenoxy)propanamide
CID 5003306
N-cyclohexyl-N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]furan-2-carboxamide
CID 3196888
N-[2-(cyclopentylamino)-2-oxo-1-pyridin-3-ylethyl]-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
CID 3196481
N-(3-chlorophenyl)-N-[2-(cyclopentylamino)-1-(2,3-dimethoxyphenyl)-2-oxoethyl]furan-2-carboxamide
CID 3196744
N-[2-(N-[2-(cyclopentylamino)-1-(furan-2-yl)-2-oxoethyl]-2-methoxyanilino)-2-oxoethyl]furan-2-carboxamide
CID 3211377

Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate?
The IUPAC name of [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate (CID 3220223) is [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate.
What is the SMILES notation for [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate?
The canonical SMILES for [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate is COc1ccccc1C(OC(=O)c1ccco1)C(=O)NC1CCCCC1.
What is the InChIKey of [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate?
The InChIKey is OSKVZDFARNSMFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-24-16-11-6-5-10-15(16)18(26-20(23)17-12-7-13-25-17)19(22)21-14-8-3-2-4-9-14/h5-7,10-14,18H,2-4,8-9H2,1H3,(H,21,22).
What are the key properties of [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate?
[2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate has a molecular weight of 357.41 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexylamino)-1-(2-methoxyphenyl)-2-oxoethyl] furan-2-carboxylate is sourced from PubChem (CID 3220223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).