3-(ethylamino)-2H-furan-5-one

C6H9NO2 — CID 14234534

IUPAC3-(ethylamino)-2H-furan-5-one
SMILESCCNC1=CC(=O)OC1
InChIInChI=1S/C6H9NO2/c1-2-7-5-3-6(8)9-4-5/h3,7H,2,4H2,1H3
InChIKeyUEHTZEKBWOWMSS-UHFFFAOYSA-N
MW127.14 g/mol
LogP0.04
Rot. Bonds2

About 3-(ethylamino)-2H-furan-5-one

3-(ethylamino)-2H-furan-5-one (PubChem CID 14234534) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is 3-(ethylamino)-2H-furan-5-one.

Molecular Properties

Compound Name3-(ethylamino)-2H-furan-5-one
PubChem CID14234534
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC Name3-(ethylamino)-2H-furan-5-one
SMILESCCNC1=CC(=O)OC1
InChIInChI=1S/C6H9NO2/c1-2-7-5-3-6(8)9-4-5/h3,7H,2,4H2,1H3
InChIKeyUEHTZEKBWOWMSS-UHFFFAOYSA-N
XLogP0.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(ethylamino)-2H-furan-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ethyl 3-(methylamino)but-2-enoate
CID 5369131
Methyl 3-methylaminocrotonate
CID 5702622
methyl (E)-3-(methylamino)but-2-enoate
CID 5846045
2-Butenoic acid, 3-(methylamino)-, ethyl ester
CID 247452
Methyl 3-(methylamino)but-2-enoate
CID 2734182
Ethyl 3-(methylamino)-2-butenoate
CID 6112842
4-((2,2-Difluoroethyl)amino)-2,5-dihydrofuran-2-one
CID 76970572
Ethyl 3-butylaminocrotonate
CID 11788689
Methyl (z)-3-[(2-hydroxyethyl)amino]but-2-enoate
CID 12722161
(Z)-3-Isopropylamino-but-2-enoic acid ethyl ester
CID 12127897
ethyl (E)-3-(2-hydroxyethylamino)but-2-enoate
CID 6309471
ethyl (Z)-3-(2,2-diethoxyethylamino)but-2-enoate
CID 101395602

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-2H-furan-5-one?
The IUPAC name of 3-(ethylamino)-2H-furan-5-one (CID 14234534) is 3-(ethylamino)-2H-furan-5-one.
What is the SMILES notation for 3-(ethylamino)-2H-furan-5-one?
The canonical SMILES for 3-(ethylamino)-2H-furan-5-one is CCNC1=CC(=O)OC1.
What is the InChIKey of 3-(ethylamino)-2H-furan-5-one?
The InChIKey is UEHTZEKBWOWMSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2/c1-2-7-5-3-6(8)9-4-5/h3,7H,2,4H2,1H3.
What are the key properties of 3-(ethylamino)-2H-furan-5-one?
3-(ethylamino)-2H-furan-5-one has a molecular weight of 127.14 g/mol, XLogP of 0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-2H-furan-5-one is sourced from PubChem (CID 14234534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).