(2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide

C19H31NO3 — CID 100739126

IUPAC(2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide
SMILESCCCO[C@](C)(CC(C)C)C(=O)Nc1cc(C)c(OC)c(C)c1
InChIInChI=1S/C19H31NO3/c1-8-9-23-19(6,12-13(2)3)18(21)20-16-10-14(4)17(22-7)15(5)11-16/h10-11,13H,8-9,12H2,1-7H3,(H,20,21)/t19-/m1/s1
InChIKeyROSLOKHIELTWNA-LJQANCHMSA-N
MW321.46 g/mol
LogP4.48
Rot. Bonds8

About (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide

(2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide (PubChem CID 100739126) has the molecular formula C19H31NO3 and a molecular weight of 321.46 g/mol. Its IUPAC name is (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide.

Molecular Properties

Compound Name(2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide
PubChem CID100739126
Molecular FormulaC19H31NO3
Molecular Weight321.46 g/mol
Exact Mass321.23
IUPAC Name(2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide
SMILESCCCO[C@](C)(CC(C)C)C(=O)Nc1cc(C)c(OC)c(C)c1
InChIInChI=1S/C19H31NO3/c1-8-9-23-19(6,12-13(2)3)18(21)20-16-10-14(4)17(22-7)15(5)11-16/h10-11,13H,8-9,12H2,1-7H3,(H,20,21)/t19-/m1/s1
InChIKeyROSLOKHIELTWNA-LJQANCHMSA-N
XLogP4.48
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.46
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[3,5-dimethyl-4-(2-methylpropoxy)phenyl]-2,4-dimethyl-2-propoxypentanamide
CID 100739252
(2S)-N-(3,5-dimethyl-4-propoxyphenyl)-2-ethoxy-2,4-dimethylpentanamide
CID 100723924
N-(4-methoxy-3,5-dimethylphenyl)-2-methyl-2-propoxyhexanamide
CID 133254721
(2R)-N-(6-methoxy-5-methyl-3-pyridinyl)-2,4-dimethyl-2-propoxypentanamide
CID 100777758
(2S)-N-(4-ethoxy-3,5-dimethylphenyl)-2-methoxy-2,4-dimethylpentanamide
CID 100696262
(2R)-N-(4-ethoxy-3,5-dimethylphenyl)-2-methoxy-2,4-dimethylpentanamide
CID 100696250
N-(3,5-dimethyl-4-propoxyphenyl)-4-methyl-2-(2-methylpropyl)-2-propoxypentanamide
CID 100741200
(2R)-N-[4-[(2S)-butan-2-yl]oxy-3,5-dimethylphenyl]-2-methyl-2-propoxypentanamide
CID 100740417
(2R)-N-[3,5-dimethyl-4-(2-methylpropoxy)phenyl]-2-methyl-2-propoxyheptanamide
CID 100712023
(2R)-N-[4-[(2S)-butan-2-yl]oxy-3,5-dimethylphenyl]-2-methoxy-2,4-dimethylpentanamide
CID 100696366
N-(3,5-dimethyl-4-phenylmethoxyphenyl)-2-ethoxy-2,4-dimethylpentanamide
CID 133246592
(2S)-N-[4-methoxy-3-(trifluoromethyl)phenyl]-2,4-dimethyl-2-propoxypentanamide
CID 100764483

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide?
The IUPAC name of (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide (CID 100739126) is (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide.
What is the SMILES notation for (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide?
The canonical SMILES for (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide is CCCO[C@](C)(CC(C)C)C(=O)Nc1cc(C)c(OC)c(C)c1.
What is the InChIKey of (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide?
The InChIKey is ROSLOKHIELTWNA-LJQANCHMSA-N. The full InChI is InChI=1S/C19H31NO3/c1-8-9-23-19(6,12-13(2)3)18(21)20-16-10-14(4)17(22-7)15(5)11-16/h10-11,13H,8-9,12H2,1-7H3,(H,20,21)/t19-/m1/s1.
What are the key properties of (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide?
(2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide has a molecular weight of 321.46 g/mol, XLogP of 4.48, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-methoxy-3,5-dimethylphenyl)-2,4-dimethyl-2-propoxypentanamide is sourced from PubChem (CID 100739126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).