5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide

C11H17NO3 — CID 65034203

IUPAC5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCC(C)CO)o1
InChIInChI=1S/C11H17NO3/c1-3-9-4-5-10(15-9)11(14)12-6-8(2)7-13/h4-5,8,13H,3,6-7H2,1-2H3,(H,12,14)
InChIKeySODYQWDVGWXILA-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.20
Rot. Bonds5

About 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide

5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide (PubChem CID 65034203) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide
PubChem CID65034203
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCC(C)CO)o1
InChIInChI=1S/C11H17NO3/c1-3-9-4-5-10(15-9)11(14)12-6-8(2)7-13/h4-5,8,13H,3,6-7H2,1-2H3,(H,12,14)
InChIKeySODYQWDVGWXILA-UHFFFAOYSA-N
XLogP1.20
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2-hydroxy-3-oxopropyl)-5-ethylfuran-2-carboxamide
CID 106166165
5-ethyl-N-(2-hydroxy-2-phenylethyl)furan-2-carboxamide
CID 43427837
N-(2-chloro-2-phenylethyl)-5-ethylfuran-2-carboxamide
CID 113271401
5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide
CID 107299752
5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide
CID 110888986
N-[2-(2,6-dichlorophenyl)-2-hydroxyethyl]-5-ethylfuran-2-carboxamide
CID 111452382
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
N-(2-chloroprop-2-enyl)-5-ethylfuran-2-carboxamide
CID 115636695
5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide
CID 115764668
N-(2-bromoprop-2-enyl)-5-ethylfuran-2-carboxamide
CID 115594455
5-ethyl-N-(3-iodopropyl)furan-2-carboxamide
CID 114504288
N-[2-(5-chlorothiophen-2-yl)-2-hydroxyethyl]-5-ethylfuran-2-carboxamide
CID 71989468

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide (CID 65034203) is 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide is CCc1ccc(C(=O)NCC(C)CO)o1.
What is the InChIKey of 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide?
The InChIKey is SODYQWDVGWXILA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-3-9-4-5-10(15-9)11(14)12-6-8(2)7-13/h4-5,8,13H,3,6-7H2,1-2H3,(H,12,14).
What are the key properties of 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide?
5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide has a molecular weight of 211.26 g/mol, XLogP of 1.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide is sourced from PubChem (CID 65034203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).