4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide

C9H18N2O3 — CID 66239012

IUPAC4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide
SMILESCCOCCNC(=O)C1COCC1N
InChIInChI=1S/C9H18N2O3/c1-2-13-4-3-11-9(12)7-5-14-6-8(7)10/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeySBNIVUZUXGMCFD-UHFFFAOYSA-N
MW202.25 g/mol
LogP-0.89
Rot. Bonds5

About 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide

4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide (PubChem CID 66239012) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide
PubChem CID66239012
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide
SMILESCCOCCNC(=O)C1COCC1N
InChIInChI=1S/C9H18N2O3/c1-2-13-4-3-11-9(12)7-5-14-6-8(7)10/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKeySBNIVUZUXGMCFD-UHFFFAOYSA-N
XLogP-0.89
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-hexyloxolane-3-carboxamide
CID 66238816
4-amino-N-[3-(2-methylpropoxy)propyl]oxolane-3-carboxamide
CID 66241397
methyl 4-[(4-aminooxolane-3-carbonyl)amino]butanoate
CID 66237074
4-amino-N-(2-ethoxy-2-methylpropyl)oxolane-3-carboxamide
CID 114942260
4-amino-N-(3,3,3-trifluoropropyl)oxolane-3-carboxamide
CID 66237706
4-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]oxolane-3-carboxamide
CID 114134099
4-amino-N-(2,2-dimethylpropyl)oxolane-3-carboxamide
CID 66237269
4-amino-N-[3-(2-methylpropylamino)-3-oxopropyl]oxolane-3-carboxamide
CID 113410096
7-[(4-aminooxolane-3-carbonyl)amino]heptanoic acid
CID 66235647
4-amino-N-[2-(azepan-1-yl)ethyl]oxolane-3-carboxamide
CID 66235652
N-(2-butoxyethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255585
4-amino-N-[2-(1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
CID 66237908

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide (CID 66239012) is 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide is CCOCCNC(=O)C1COCC1N.
What is the InChIKey of 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide?
The InChIKey is SBNIVUZUXGMCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-2-13-4-3-11-9(12)7-5-14-6-8(7)10/h7-8H,2-6,10H2,1H3,(H,11,12).
What are the key properties of 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide?
4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide has a molecular weight of 202.25 g/mol, XLogP of -0.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethoxyethyl)oxolane-3-carboxamide is sourced from PubChem (CID 66239012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).