(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide

C15H23NO3 — CID 100693286

IUPAC(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide
SMILESCCCOc1ccc(NC(=O)[C@](C)(CC)OC)cc1
InChIInChI=1S/C15H23NO3/c1-5-11-19-13-9-7-12(8-10-13)16-14(17)15(3,6-2)18-4/h7-10H,5-6,11H2,1-4H3,(H,16,17)/t15-/m0/s1
InChIKeyWBMAEVQHXJFHOY-HNNXBMFYSA-N
MW265.35 g/mol
LogP3.23
Rot. Bonds7

About (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide

(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide (PubChem CID 100693286) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide.

Molecular Properties

Compound Name(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide
PubChem CID100693286
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide
SMILESCCCOc1ccc(NC(=O)[C@](C)(CC)OC)cc1
InChIInChI=1S/C15H23NO3/c1-5-11-19-13-9-7-12(8-10-13)16-14(17)15(3,6-2)18-4/h7-10H,5-6,11H2,1-4H3,(H,16,17)/t15-/m0/s1
InChIKeyWBMAEVQHXJFHOY-HNNXBMFYSA-N
XLogP3.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-butoxyphenyl)-2-methoxy-2-methylbutanamide
CID 133245858
(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)pentanamide
CID 100696786
(2R)-N-[4-(2-bromoethoxy)phenyl]-2-methoxy-2-methylbutanamide
CID 100693614
N-[4-(2-amino-2-oxoethoxy)phenyl]-2-methoxy-2-methylbutanamide
CID 133245864
(2S)-N-[4-(2-bromoethoxy)phenyl]-2-methoxy-2-methylpentanamide
CID 100697214
(2R)-2-methyl-2-propoxy-N-(4-propoxyphenyl)hexanamide
CID 100741376
N-[4-(2-bromoethoxy)phenyl]-2-methoxy-2-methylhexanamide
CID 133246014
N-[4-(2-ethoxyethoxy)phenyl]-2-methoxy-2-methylpentanamide
CID 133245970
N-[4-(2-ethoxyethoxy)phenyl]-2-methoxy-2-methylhexanamide
CID 133167167
(2R)-N-[4-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethoxy]phenyl]-2-methoxy-2-methylbutanamide
CID 100693894
(2S)-N-[4-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethoxy]phenyl]-2-methoxy-2-methylbutanamide
CID 100693908
2-[4-[(2-methyl-2-propoxybutanoyl)amino]phenoxy]acetic acid
CID 133246947

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide?
The IUPAC name of (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide (CID 100693286) is (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide.
What is the SMILES notation for (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide?
The canonical SMILES for (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide is CCCOc1ccc(NC(=O)[C@](C)(CC)OC)cc1.
What is the InChIKey of (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide?
The InChIKey is WBMAEVQHXJFHOY-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-5-11-19-13-9-7-12(8-10-13)16-14(17)15(3,6-2)18-4/h7-10H,5-6,11H2,1-4H3,(H,16,17)/t15-/m0/s1.
What are the key properties of (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide?
(2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide has a molecular weight of 265.35 g/mol, XLogP of 3.23, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-2-methyl-N-(4-propoxyphenyl)butanamide is sourced from PubChem (CID 100693286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).