4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide

C13H18N2O3 — CID 66241179

IUPAC4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide
SMILESCCOc1ccc(NC(=O)C2COCC2N)cc1
InChIInChI=1S/C13H18N2O3/c1-2-18-10-5-3-9(4-6-10)15-13(16)11-7-17-8-12(11)14/h3-6,11-12H,2,7-8,14H2,1H3,(H,15,16)
InChIKeyRZGJRPYXMCAQGI-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.00
Rot. Bonds4

About 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide

4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide (PubChem CID 66241179) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide
PubChem CID66241179
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide
SMILESCCOc1ccc(NC(=O)C2COCC2N)cc1
InChIInChI=1S/C13H18N2O3/c1-2-18-10-5-3-9(4-6-10)15-13(16)11-7-17-8-12(11)14/h3-6,11-12H,2,7-8,14H2,1H3,(H,15,16)
InChIKeyRZGJRPYXMCAQGI-UHFFFAOYSA-N
XLogP1.00
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(4-aminooxolane-3-carbonyl)amino]phenoxy]acetic acid
CID 66237709
4-amino-N-(4-propan-2-yloxyphenyl)oxolane-3-carboxamide
CID 66239409
1-N-(4-chlorophenyl)-2-N-(4-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142941
4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide
CID 66239651
4-amino-N-(4-ethoxyphenyl)cyclopent-2-ene-1-carboxamide
CID 79211304
methyl 4-[[2-[(4-ethoxyphenyl)carbamoyl]cyclopropanecarbonyl]amino]benzoate
CID 109143528
4-amino-N-(1-methyl-6-oxo-3-pyridinyl)oxolane-3-carboxamide
CID 66239661
(1R,6S)-6-[(4-ethoxyphenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate
CID 7409849
(2S)-1-N,2-N-bis(4-ethoxyphenyl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 21177970
(1R,5S)-N-(4-ethoxyphenyl)-3-oxa-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 95986000
(1R,2R,4S)-N-(4-ethoxyphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 839866
(1S,2S,4S)-N-(4-ethoxyphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 7101788

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide (CID 66241179) is 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide is CCOc1ccc(NC(=O)C2COCC2N)cc1.
What is the InChIKey of 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide?
The InChIKey is RZGJRPYXMCAQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-2-18-10-5-3-9(4-6-10)15-13(16)11-7-17-8-12(11)14/h3-6,11-12H,2,7-8,14H2,1H3,(H,15,16).
What are the key properties of 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide?
4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide is sourced from PubChem (CID 66241179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).