4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide

C14H20N2O3 — CID 66239651

IUPAC4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide
SMILESCCOc1cccc(CNC(=O)C2COCC2N)c1
InChIInChI=1S/C14H20N2O3/c1-2-19-11-5-3-4-10(6-11)7-16-14(17)12-8-18-9-13(12)15/h3-6,12-13H,2,7-9,15H2,1H3,(H,16,17)
InChIKeyFNSBKAXHXRQVPR-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.68
Rot. Bonds5

About 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide

4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide (PubChem CID 66239651) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide
PubChem CID66239651
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide
SMILESCCOc1cccc(CNC(=O)C2COCC2N)c1
InChIInChI=1S/C14H20N2O3/c1-2-19-11-5-3-4-10(6-11)7-16-14(17)12-8-18-9-13(12)15/h3-6,12-13H,2,7-9,15H2,1H3,(H,16,17)
InChIKeyFNSBKAXHXRQVPR-UHFFFAOYSA-N
XLogP0.68
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[(3-ethoxyphenyl)methyl]-3-methyloxolane-3-carboxamide
CID 66250428
4-[(3-ethoxyphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120672581
4-(ethylamino)-N-[(3-methoxyphenyl)methyl]oxolane-3-carboxamide
CID 66257709
4-amino-N-(4-ethoxyphenyl)oxolane-3-carboxamide
CID 66241179
N-[(3-ethoxyphenyl)methyl]-1-(oxan-4-yl)azetidine-3-carboxamide
CID 126826252
methyl 4-[[(4-aminooxolane-3-carbonyl)amino]methyl]benzoate
CID 66237277
4-amino-N-[(4-propan-2-ylphenyl)methyl]oxolane-3-carboxamide
CID 66236279
4-amino-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)oxolane-3-carboxamide
CID 66236465
4-amino-N-[(3-ethyl-2-pyridinyl)methyl]oxolane-3-carboxamide
CID 82737954
(2S)-N-[(3-ethoxyphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119714472
N-[(3-ethoxyphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119284494
N-[(3-ethoxyphenyl)methyl]-1,1-dioxothiane-2-carboxamide
CID 75455420

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide (CID 66239651) is 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide is CCOc1cccc(CNC(=O)C2COCC2N)c1.
What is the InChIKey of 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide?
The InChIKey is FNSBKAXHXRQVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-19-11-5-3-4-10(6-11)7-16-14(17)12-8-18-9-13(12)15/h3-6,12-13H,2,7-9,15H2,1H3,(H,16,17).
What are the key properties of 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide?
4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(3-ethoxyphenyl)methyl]oxolane-3-carboxamide is sourced from PubChem (CID 66239651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).