N-ethyl-2,5-dimethylfuran-3-carboxamide

C9H13NO2 — CID 18712273

IUPACN-ethyl-2,5-dimethylfuran-3-carboxamide
SMILESCCNC(=O)c1cc(C)oc1C
InChIInChI=1S/C9H13NO2/c1-4-10-9(11)8-5-6(2)12-7(8)3/h5H,4H2,1-3H3,(H,10,11)
InChIKeyFSISBKUVPBDDLL-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.65
Rot. Bonds2

About N-ethyl-2,5-dimethylfuran-3-carboxamide

N-ethyl-2,5-dimethylfuran-3-carboxamide (PubChem CID 18712273) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is N-ethyl-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,5-dimethylfuran-3-carboxamide
PubChem CID18712273
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC NameN-ethyl-2,5-dimethylfuran-3-carboxamide
SMILESCCNC(=O)c1cc(C)oc1C
InChIInChI=1S/C9H13NO2/c1-4-10-9(11)8-5-6(2)12-7(8)3/h5H,4H2,1-3H3,(H,10,11)
InChIKeyFSISBKUVPBDDLL-UHFFFAOYSA-N
XLogP1.65
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-2,5-dimethylfuran-3-carboxamide 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

Furmecyclox
CID 43359
N-[(furan-2-yl)methyl]-2-methylfuran-3-carboxamide
CID 845080
5-(Tert-butyl)-2-methyl-3-furamide
CID 704149
4-(2,5-Dimethyl-3-furoyl)morpholine
CID 831995
4-[(5-Isobutyl-2-methyl-furan-3-carbonyl)-amino]-butyric acid
CID 2932477
(2,5-Dimethylfuran-3-yl)methanamine
CID 2776162
2-[(2,5-Dimethylfuran-3-yl)formamido]acetic acid
CID 1085174
4H,5H-furo(3,2-c)pyridin-4-one
CID 288746
N-Benzyl-3-(5-methyl-furan-2-yl)-propionamide
CID 827173
(4-Benzylpiperidin-1-yl)-(2,5-dimethylfuran-3-yl)methanone
CID 1245621
N-butyl-2-methyl-5-(piperidinosulfonyl)-3-furamide
CID 2809633
1-(2,5-Dimethylfuran-3-carbonyl)piperidine-4-carboxylic acid
CID 2813437

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-ethyl-2,5-dimethylfuran-3-carboxamide (CID 18712273) is N-ethyl-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-ethyl-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-ethyl-2,5-dimethylfuran-3-carboxamide is CCNC(=O)c1cc(C)oc1C.
What is the InChIKey of N-ethyl-2,5-dimethylfuran-3-carboxamide?
The InChIKey is FSISBKUVPBDDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-4-10-9(11)8-5-6(2)12-7(8)3/h5H,4H2,1-3H3,(H,10,11).
What are the key properties of N-ethyl-2,5-dimethylfuran-3-carboxamide?
N-ethyl-2,5-dimethylfuran-3-carboxamide has a molecular weight of 167.21 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 18712273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).