5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide

C10H13NO3 — CID 114820799

IUPAC5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide
SMILESCC(=O)C(C)NC(=O)c1coc(C)c1
InChIInChI=1S/C10H13NO3/c1-6-4-9(5-14-6)10(13)11-7(2)8(3)12/h4-5,7H,1-3H3,(H,11,13)
InChIKeyBUQMDTJBZNPMKE-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.30
Rot. Bonds3

About 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide

5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide (PubChem CID 114820799) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide
PubChem CID114820799
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide
SMILESCC(=O)C(C)NC(=O)c1coc(C)c1
InChIInChI=1S/C10H13NO3/c1-6-4-9(5-14-6)10(13)11-7(2)8(3)12/h4-5,7H,1-3H3,(H,11,13)
InChIKeyBUQMDTJBZNPMKE-UHFFFAOYSA-N
XLogP1.30
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-1-hydroxyiminopropan-2-yl)-5-methylfuran-3-carboxamide
CID 104979012
(2R)-3-methyl-2-[(5-methylfuran-3-carbonyl)amino]butanoic acid
CID 1273432
N-but-3-yn-2-yl-5-methylfuran-3-carboxamide
CID 114822800
N-(1-cyanoethyl)-5-methylfuran-3-carboxamide
CID 114820587
N-(4-bromobutan-2-yl)-5-methylfuran-3-carboxamide
CID 114823351
N-(1-iodo-3-methylbutan-2-yl)-5-methylfuran-3-carboxamide
CID 107860051
N-(1-amino-3-methyl-1-sulfanylidenebutan-2-yl)-5-methylfuran-3-carboxamide
CID 114820763
N-(3-oxobutan-2-yl)furan-3-carboxamide
CID 64997031
(2S)-2-[(5-methylfuran-3-carbonyl)amino]butanoic acid
CID 104978924
5-methyl-N-(3-oxobutan-2-yl)-1,2-oxazole-3-carboxamide
CID 66157356
2-[(5-methylfuran-3-carbonyl)amino]pentanoic acid
CID 114818817
N-[1-(3-aminophenyl)ethyl]-5-methylfuran-3-carboxamide
CID 114818581

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide?
The IUPAC name of 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide (CID 114820799) is 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide?
The canonical SMILES for 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide is CC(=O)C(C)NC(=O)c1coc(C)c1.
What is the InChIKey of 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide?
The InChIKey is BUQMDTJBZNPMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-6-4-9(5-14-6)10(13)11-7(2)8(3)12/h4-5,7H,1-3H3,(H,11,13).
What are the key properties of 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide?
5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide has a molecular weight of 195.22 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-oxobutan-2-yl)furan-3-carboxamide is sourced from PubChem (CID 114820799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).