N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide

C13H21NO3 — CID 86926941

IUPACN-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide
SMILESCCN(CC(C)C)C(=O)c1ccc(COC)o1
InChIInChI=1S/C13H21NO3/c1-5-14(8-10(2)3)13(15)12-7-6-11(17-12)9-16-4/h6-7,10H,5,8-9H2,1-4H3
InChIKeyBIAXJPVNMLSMHF-UHFFFAOYSA-N
MW239.31 g/mol
LogP2.54
Rot. Bonds6

About N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide

N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide (PubChem CID 86926941) has the molecular formula C13H21NO3 and a molecular weight of 239.31 g/mol. Its IUPAC name is N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide
PubChem CID86926941
Molecular FormulaC13H21NO3
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC NameN-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide
SMILESCCN(CC(C)C)C(=O)c1ccc(COC)o1
InChIInChI=1S/C13H21NO3/c1-5-14(8-10(2)3)13(15)12-7-6-11(17-12)9-16-4/h6-7,10H,5,8-9H2,1-4H3
InChIKeyBIAXJPVNMLSMHF-UHFFFAOYSA-N
XLogP2.54
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(methoxymethyl)-N-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]furan-2-carboxamide
CID 46983940
5-(methoxymethyl)-N-methyl-N-(3-methylbutyl)furan-2-carboxamide
CID 78853341
N-ethyl-5-(methoxymethyl)-N-[(2-methylphenyl)methyl]furan-2-carboxamide
CID 78852716
2-[butan-2-yl-[5-(methoxymethyl)furan-2-carbonyl]amino]acetic acid
CID 119954509
5-(bromomethyl)-N,N-diethylfuran-2-carboxamide
CID 134860219
5-(methoxymethyl)-N-(7-methyloctyl)furan-2-carboxamide
CID 78847305
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912260
5-(methoxymethyl)furan-2-carbonyl chloride
CID 45081463
N-(2-aminoethyl)-5-(methoxymethyl)-N-(2-phenylethyl)furan-2-carboxamide
CID 120885996
5-(methoxymethyl)-N-[1-(2-methoxyphenyl)ethyl]-N-methylfuran-2-carboxamide
CID 78852151
N-[(2R)-2-(ethylamino)propyl]-5-(methoxymethyl)furan-2-carboxamide
CID 120650443
5-(methoxymethyl)-N-(3-propan-2-yloxypropyl)furan-2-carboxamide
CID 78827233

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide?
The IUPAC name of N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide (CID 86926941) is N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide.
What is the SMILES notation for N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide?
The canonical SMILES for N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide is CCN(CC(C)C)C(=O)c1ccc(COC)o1.
What is the InChIKey of N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide?
The InChIKey is BIAXJPVNMLSMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO3/c1-5-14(8-10(2)3)13(15)12-7-6-11(17-12)9-16-4/h6-7,10H,5,8-9H2,1-4H3.
What are the key properties of N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide?
N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide has a molecular weight of 239.31 g/mol, XLogP of 2.54, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide is sourced from PubChem (CID 86926941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).