N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide

C9H15NO4 — CID 123589572

IUPACN,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide
SMILESO=C(C1=CCCO1)N(CCO)CCO
InChIInChI=1S/C9H15NO4/c11-5-3-10(4-6-12)9(13)8-2-1-7-14-8/h2,11-12H,1,3-7H2
InChIKeyVJGUWEHQFQYJBP-UHFFFAOYSA-N
MW201.22 g/mol
LogP-0.90
Rot. Bonds5

About N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide

N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide (PubChem CID 123589572) has the molecular formula C9H15NO4 and a molecular weight of 201.22 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide
PubChem CID123589572
Molecular FormulaC9H15NO4
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC NameN,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide
SMILESO=C(C1=CCCO1)N(CCO)CCO
InChIInChI=1S/C9H15NO4/c11-5-3-10(4-6-12)9(13)8-2-1-7-14-8/h2,11-12H,1,3-7H2
InChIKeyVJGUWEHQFQYJBP-UHFFFAOYSA-N
XLogP-0.90
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide (CID 123589572) is N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide is O=C(C1=CCCO1)N(CCO)CCO.
What is the InChIKey of N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide?
The InChIKey is VJGUWEHQFQYJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO4/c11-5-3-10(4-6-12)9(13)8-2-1-7-14-8/h2,11-12H,1,3-7H2.
What are the key properties of N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide?
N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide has a molecular weight of 201.22 g/mol, XLogP of -0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide is sourced from PubChem (CID 123589572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).