[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate

C15H20N2O5 — CID 7880332

IUPAC[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
SMILESO=C(COC(=O)CNC(=O)c1ccco1)NC1CCCCC1
InChIInChI=1S/C15H20N2O5/c18-13(17-11-5-2-1-3-6-11)10-22-14(19)9-16-15(20)12-7-4-8-21-12/h4,7-8,11H,1-3,5-6,9-10H2,(H,16,20)(H,17,18)
InChIKeySTGPBSPRWLZQCF-UHFFFAOYSA-N
MW308.33 g/mol
LogP1.00
Rot. Bonds6

About [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate

[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate (PubChem CID 7880332) has the molecular formula C15H20N2O5 and a molecular weight of 308.33 g/mol. Its IUPAC name is [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate.

Molecular Properties

Compound Name[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
PubChem CID7880332
Molecular FormulaC15H20N2O5
Molecular Weight308.33 g/mol
Exact Mass308.14
IUPAC Name[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
SMILESO=C(COC(=O)CNC(=O)c1ccco1)NC1CCCCC1
InChIInChI=1S/C15H20N2O5/c18-13(17-11-5-2-1-3-6-11)10-22-14(19)9-16-15(20)12-7-4-8-21-12/h4,7-8,11H,1-3,5-6,9-10H2,(H,16,20)(H,17,18)
InChIKeySTGPBSPRWLZQCF-UHFFFAOYSA-N
XLogP1.00
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.33
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
CID 11934497
[2-(cyclooctylamino)-2-oxoethyl] (2S)-2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 7858566
N-cyclooctylfuran-2-carboxamide
CID 790432
[2-(cyclooctylamino)-2-oxoethyl] 2-[(4-bromobenzoyl)amino]acetate
CID 35643140
[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl] 3-(furan-2-carbonylamino)propanoate
CID 31403994
(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate
CID 7879888
N-[2-[[(2R,4aR,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]amino]-2-oxoethyl]furan-2-carboxamide
CID 124785873
[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl] 2-(furan-2-carbonylamino)acetate
CID 2427987
[2-(cyclooctylamino)-2-oxoethyl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate
CID 4271051
[2-(cyclopentylamino)-2-oxoethyl] 2-[(3-methylbenzoyl)amino]acetate
CID 9364084
[2-(cyclohexylamino)-2-oxoethyl] 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 7843884
[2-(2-fluoroanilino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
CID 7880328

Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate?
The IUPAC name of [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate (CID 7880332) is [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate.
What is the SMILES notation for [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate?
The canonical SMILES for [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate is O=C(COC(=O)CNC(=O)c1ccco1)NC1CCCCC1.
What is the InChIKey of [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate?
The InChIKey is STGPBSPRWLZQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O5/c18-13(17-11-5-2-1-3-6-11)10-22-14(19)9-16-15(20)12-7-4-8-21-12/h4,7-8,11H,1-3,5-6,9-10H2,(H,16,20)(H,17,18).
What are the key properties of [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate?
[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate has a molecular weight of 308.33 g/mol, XLogP of 1.00, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate is sourced from PubChem (CID 7880332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).