methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate

C10H11NO4 — CID 2767879

IUPACmethyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate
SMILESCOC(=O)c1ccc(NC(=O)C2CC2)o1
InChIInChI=1S/C10H11NO4/c1-14-10(13)7-4-5-8(15-7)11-9(12)6-2-3-6/h4-6H,2-3H2,1H3,(H,11,12)
InChIKeyRTEPEJGLTGZCPM-UHFFFAOYSA-N
MW209.20 g/mol
LogP1.41
Rot. Bonds3

About methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate

methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate (PubChem CID 2767879) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate.

Molecular Properties

Compound Namemethyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate
PubChem CID2767879
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Namemethyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate
SMILESCOC(=O)c1ccc(NC(=O)C2CC2)o1
InChIInChI=1S/C10H11NO4/c1-14-10(13)7-4-5-8(15-7)11-9(12)6-2-3-6/h4-6H,2-3H2,1H3,(H,11,12)
InChIKeyRTEPEJGLTGZCPM-UHFFFAOYSA-N
XLogP1.41
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Acetamide, N-(2-methoxycarbonylfuryl)-
CID 35757
Methyl 5-aminofuran-2-carboxylate
CID 5072225
Methyl 5-benzamidofuran-2-carboxylate
CID 2767872
Methyl 5-[(4-methylbenzoyl)amino]-2-furoate
CID 2767877
5-{[(Tert-butoxy)carbonyl]amino}furan-2-carboxylic acid
CID 54775310
Ethyl 5-acetamido-2-furoate
CID 101243
ethyl 6-oxo-4-(trifluoromethyl)-7H-furo[2,3-b]pyridine-2-carboxylate
CID 2326123
Methyl 5-[(4-fluorobenzoyl)amino]-2-furoate
CID 2767873
Methyl 5-(2-chloroacetamido)-2-furoate
CID 2777680
2-Furancarboxylic acid, 5-amino-, ethyl ester
CID 167484
Methyl 5-(5-methyl-2,4-dioxopyrimidin-1-yl)furan-2-carboxylate
CID 10125264
Diethyl 2-[[(5-methoxycarbonylfuran-2-yl)amino]methylidene]propanedioate
CID 2807392

Frequently Asked Questions

What is the IUPAC name of methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate?
The IUPAC name of methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate (CID 2767879) is methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate.
What is the SMILES notation for methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate?
The canonical SMILES for methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate is COC(=O)c1ccc(NC(=O)C2CC2)o1.
What is the InChIKey of methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate?
The InChIKey is RTEPEJGLTGZCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-14-10(13)7-4-5-8(15-7)11-9(12)6-2-3-6/h4-6H,2-3H2,1H3,(H,11,12).
What are the key properties of methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate?
methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate has a molecular weight of 209.20 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-(cyclopropanecarbonylamino)furan-2-carboxylate is sourced from PubChem (CID 2767879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).