2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide

C16H16N2O3 — CID 86851867

IUPAC2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide
SMILESCc1cccc(NC(=O)C2CC2c2ccco2)c1C(N)=O
InChIInChI=1S/C16H16N2O3/c1-9-4-2-5-12(14(9)15(17)19)18-16(20)11-8-10(11)13-6-3-7-21-13/h2-7,10-11H,8H2,1H3,(H2,17,19)(H,18,20)
InChIKeyRKOQBRXTJGXGAB-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.43
Rot. Bonds4

About 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide

2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide (PubChem CID 86851867) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide.

Molecular Properties

Compound Name2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide
PubChem CID86851867
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide
SMILESCc1cccc(NC(=O)C2CC2c2ccco2)c1C(N)=O
InChIInChI=1S/C16H16N2O3/c1-9-4-2-5-12(14(9)15(17)19)18-16(20)11-8-10(11)13-6-3-7-21-13/h2-7,10-11H,8H2,1H3,(H2,17,19)(H,18,20)
InChIKeyRKOQBRXTJGXGAB-UHFFFAOYSA-N
XLogP2.43
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 47449751
N-[2-(dimethylamino)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 47449970
N-(3-acetamido-4-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86851825
trans-(1S,2S)-N-[2-(difluoromethoxy)-6-methylphenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 95297314
ethyl N-[4-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]phenyl]carbamate
CID 86851812
N-(2,5-dimethylpyrazol-3-yl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 47449977
trans-(1S,2S)-2-(furan-2-yl)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 94817860
trans-(1R,2R)-N-(5-acetamido-2-chlorophenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 95178804
5-[[(1R,2R)-2-(furan-2-yl)cyclopropanecarbonyl]amino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 166375052
methyl 4-chloro-3-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]benzoate
CID 86851547
cis-(1R,2S)-2-(furan-2-yl)-N-(2-methyl-1,2,4-triazol-3-yl)cyclopropane-1-carboxamide
CID 97075153
N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 71920970

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide?
The IUPAC name of 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide (CID 86851867) is 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide.
What is the SMILES notation for 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide?
The canonical SMILES for 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide is Cc1cccc(NC(=O)C2CC2c2ccco2)c1C(N)=O.
What is the InChIKey of 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide?
The InChIKey is RKOQBRXTJGXGAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-9-4-2-5-12(14(9)15(17)19)18-16(20)11-8-10(11)13-6-3-7-21-13/h2-7,10-11H,8H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide?
2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide has a molecular weight of 284.32 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-6-methylbenzamide is sourced from PubChem (CID 86851867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).