4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid

C11H20N2O5 — CID 113468852

IUPAC4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid
SMILESCCN(CCCO)C(=O)NC1COCC1C(=O)O
InChIInChI=1S/C11H20N2O5/c1-2-13(4-3-5-14)11(17)12-9-7-18-6-8(9)10(15)16/h8-9,14H,2-7H2,1H3,(H,12,17)(H,15,16)
InChIKeyHNRDHSMJUUGFQS-UHFFFAOYSA-N
MW260.29 g/mol
LogP-0.50
Rot. Bonds6

About 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid

4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid (PubChem CID 113468852) has the molecular formula C11H20N2O5 and a molecular weight of 260.29 g/mol. Its IUPAC name is 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid.

Molecular Properties

Compound Name4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid
PubChem CID113468852
Molecular FormulaC11H20N2O5
Molecular Weight260.29 g/mol
Exact Mass260.14
IUPAC Name4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid
SMILESCCN(CCCO)C(=O)NC1COCC1C(=O)O
InChIInChI=1S/C11H20N2O5/c1-2-13(4-3-5-14)11(17)12-9-7-18-6-8(9)10(15)16/h8-9,14H,2-7H2,1H3,(H,12,17)(H,15,16)
InChIKeyHNRDHSMJUUGFQS-UHFFFAOYSA-N
XLogP-0.50
TPSA99.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid 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

4-[[1-hydroxypropan-2-yl(methyl)carbamoyl]amino]oxolane-3-carboxylic acid
CID 104553066
4-[[2-ethoxyethyl(methyl)carbamoyl]amino]oxolane-3-carboxylic acid
CID 81056904
4-[[ethyl(phenyl)carbamoyl]amino]oxolane-3-carboxylic acid
CID 66240338
4-[[(3-methoxy-3-oxopropyl)-methylcarbamoyl]amino]oxolane-3-carboxylic acid
CID 66240363
4-(3-methylpentanoylamino)oxolane-3-carboxylic acid
CID 114873780
4-[[[2-(cyclopropylamino)-2-oxoethyl]-methylcarbamoyl]amino]oxolane-3-carboxylic acid
CID 66241556
4-[4-(dimethylamino)butylcarbamoylamino]oxolane-3-carboxylic acid
CID 66240170
N-[3-(dimethylamino)propyl]-N-ethyl-4-(methylamino)oxolane-3-carboxamide
CID 102992836
4-[2-(dimethylamino)propylcarbamoylamino]oxolane-3-carboxylic acid
CID 66239576
3-[[ethyl(2-hydroxyethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 66032028
4-[[methyl(pyridin-4-ylmethyl)carbamoyl]amino]oxolane-3-carboxylic acid
CID 66239350
N,N-diethyl-4-(methylamino)oxolane-3-carboxamide
CID 66265754

Frequently Asked Questions

What is the IUPAC name of 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid?
The IUPAC name of 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid (CID 113468852) is 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid.
What is the SMILES notation for 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid?
The canonical SMILES for 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid is CCN(CCCO)C(=O)NC1COCC1C(=O)O.
What is the InChIKey of 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid?
The InChIKey is HNRDHSMJUUGFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5/c1-2-13(4-3-5-14)11(17)12-9-7-18-6-8(9)10(15)16/h8-9,14H,2-7H2,1H3,(H,12,17)(H,15,16).
What are the key properties of 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid?
4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid has a molecular weight of 260.29 g/mol, XLogP of -0.50, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(3-hydroxypropyl)carbamoyl]amino]oxolane-3-carboxylic acid is sourced from PubChem (CID 113468852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).