(2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide

C16H23NO4 — CID 124881098

IUPAC(2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide
SMILESCCOc1ccc([C@@H](COC)NC(=O)[C@H]2CCCO2)cc1
InChIInChI=1S/C16H23NO4/c1-3-20-13-8-6-12(7-9-13)14(11-19-2)17-16(18)15-5-4-10-21-15/h6-9,14-15H,3-5,10-11H2,1-2H3,(H,17,18)/t14-,15-/m1/s1
InChIKeyILBDDMJZSBNUGS-HUUCEWRRSA-N
MW293.36 g/mol
LogP2.07
Rot. Bonds7

About (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide

(2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide (PubChem CID 124881098) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide
PubChem CID124881098
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC Name(2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide
SMILESCCOc1ccc([C@@H](COC)NC(=O)[C@H]2CCCO2)cc1
InChIInChI=1S/C16H23NO4/c1-3-20-13-8-6-12(7-9-13)14(11-19-2)17-16(18)15-5-4-10-21-15/h6-9,14-15H,3-5,10-11H2,1-2H3,(H,17,18)/t14-,15-/m1/s1
InChIKeyILBDDMJZSBNUGS-HUUCEWRRSA-N
XLogP2.07
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-ethoxyphenyl)ethyl]oxolane-2-carboxamide
CID 17173548
N-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethyl]oxolane-2-carboxamide
CID 108541899
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]thiomorpholine-4-carboxamide
CID 124847644
methyl (3R)-3-(4-methylsulfanylphenyl)-3-[[(2S)-oxolane-2-carbonyl]amino]propanoate
CID 95304839
N-[cyclopropyl-(4-methoxyphenyl)methyl]oxolane-2-carboxamide
CID 46449818
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]-6-methylpyridine-3-carboxamide
CID 124730066
propan-2-yl 3-(oxolane-2-carbonylamino)-3-phenylpropanoate
CID 43048320
N-[(1S)-2-amino-1-phenylethyl]oxolane-2-carboxamide
CID 57091313
N-(2-amino-1-phenylethyl)oxolane-2-carboxamide
CID 55242926
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]-2-methylpyrazole-3-carboxamide
CID 100646270
methyl (3S)-3-(3,4-dimethoxyphenyl)-3-[[(2S)-oxolane-2-carbonyl]amino]propanoate
CID 94016796
4-[[[1-(4-ethoxyphenyl)-2-methoxyethyl]amino]methyl]benzoic acid
CID 122034082

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide (CID 124881098) is (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide is CCOc1ccc([C@@H](COC)NC(=O)[C@H]2CCCO2)cc1.
What is the InChIKey of (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide?
The InChIKey is ILBDDMJZSBNUGS-HUUCEWRRSA-N. The full InChI is InChI=1S/C16H23NO4/c1-3-20-13-8-6-12(7-9-13)14(11-19-2)17-16(18)15-5-4-10-21-15/h6-9,14-15H,3-5,10-11H2,1-2H3,(H,17,18)/t14-,15-/m1/s1.
What are the key properties of (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide?
(2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide has a molecular weight of 293.36 g/mol, XLogP of 2.07, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]oxolane-2-carboxamide is sourced from PubChem (CID 124881098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).