(2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide

C17H25NO3 — CID 51947949

IUPAC(2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide
SMILESCC[C@@H](NC(=O)[C@H]1CCCO1)c1ccccc1OC(C)C
InChIInChI=1S/C17H25NO3/c1-4-14(18-17(19)16-10-7-11-20-16)13-8-5-6-9-15(13)21-12(2)3/h5-6,8-9,12,14,16H,4,7,10-11H2,1-3H3,(H,18,19)/t14-,16-/m1/s1
InChIKeyVWAZFTUWTZTFHD-GDBMZVCRSA-N
MW291.39 g/mol
LogP3.22
Rot. Bonds6

About (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide

(2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide (PubChem CID 51947949) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide
PubChem CID51947949
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name(2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide
SMILESCC[C@@H](NC(=O)[C@H]1CCCO1)c1ccccc1OC(C)C
InChIInChI=1S/C17H25NO3/c1-4-14(18-17(19)16-10-7-11-20-16)13-8-5-6-9-15(13)21-12(2)3/h5-6,8-9,12,14,16H,4,7,10-11H2,1-3H3,(H,18,19)/t14-,16-/m1/s1
InChIKeyVWAZFTUWTZTFHD-GDBMZVCRSA-N
XLogP3.22
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-ethoxyphenyl)propyl]morpholine-2-carboxamide
CID 119721402
propan-2-yl 3-(oxolane-2-carbonylamino)-3-phenylpropanoate
CID 43048320
N-[2-(2-fluorophenoxy)butyl]oxolane-2-carboxamide
CID 71863283
2-[1-(2-propan-2-yloxyphenyl)propylcarbamoylamino]propanediamide
CID 56795656
(2S)-N-[(1S)-1-phenylethyl]oxolane-2-carboxamide
CID 896917
N-[6-(2-propan-2-yloxyanilino)pyridazin-3-yl]oxolane-2-carboxamide
CID 113048618
N-(2-amino-1-phenylethyl)oxolane-2-carboxamide
CID 55242926
N-[(1S)-2-amino-1-phenylethyl]oxolane-2-carboxamide
CID 57091313
(2R)-N-(6-methylheptan-3-yl)oxolane-2-carboxamide
CID 163590521
N-[1-(4-ethoxyphenyl)ethyl]oxolane-2-carboxamide
CID 17173548
(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
CID 40532664
(2S)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]oxolane-2-carboxamide
CID 40939596

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide (CID 51947949) is (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide is CC[C@@H](NC(=O)[C@H]1CCCO1)c1ccccc1OC(C)C.
What is the InChIKey of (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide?
The InChIKey is VWAZFTUWTZTFHD-GDBMZVCRSA-N. The full InChI is InChI=1S/C17H25NO3/c1-4-14(18-17(19)16-10-7-11-20-16)13-8-5-6-9-15(13)21-12(2)3/h5-6,8-9,12,14,16H,4,7,10-11H2,1-3H3,(H,18,19)/t14-,16-/m1/s1.
What are the key properties of (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide?
(2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide has a molecular weight of 291.39 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1R)-1-(2-propan-2-yloxyphenyl)propyl]oxolane-2-carboxamide is sourced from PubChem (CID 51947949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).