N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide

C19H23NO3 — CID 134113096

IUPACN-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide
SMILESCON(C)C(=O)C(C)(C)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H23NO3/c1-19(2,18(21)20(3)22-4)16-10-12-17(13-11-16)23-14-15-8-6-5-7-9-15/h5-13H,14H2,1-4H3
InChIKeyCFMUSCVGABJDME-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.56
Rot. Bonds6

About N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide

N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide (PubChem CID 134113096) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide
PubChem CID134113096
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide
SMILESCON(C)C(=O)C(C)(C)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H23NO3/c1-19(2,18(21)20(3)22-4)16-10-12-17(13-11-16)23-14-15-8-6-5-7-9-15/h5-13H,14H2,1-4H3
InChIKeyCFMUSCVGABJDME-UHFFFAOYSA-N
XLogP3.56
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-hydroxy-2-(4-phenylmethoxyphenyl)propanoic acid
CID 131871320
methyl 2-hydroxy-2-phenyl-2-(4-phenylmethoxyphenyl)acetate
CID 563862
2-hydroxy-2-phenyl-2-(4-phenylmethoxyphenyl)acetamide
CID 139613624
tert-butyl N-[(2S)-1-[methoxy(methyl)amino]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamate
CID 15659549
4-phenylmethoxybenzoic acid
CID 68896574
2,2-dimethyl-1-(4-phenylmethoxyphenyl)propan-1-one
CID 14125672
1-(2,4-dimethylpent-4-en-2-yl)-4-phenylmethoxybenzene
CID 146167604
(2S)-2,3-dimethyl-3-(4-phenylmethoxyphenyl)-2-silyloxybutanoic acid
CID 173241831
tert-butyl (2R)-2-amino-3-hydroxy-2-(4-phenylmethoxyphenyl)propanoate
CID 174448640
methyl (2R,3R)-3-hydroxy-2-methyl-2-phenyl-3-(4-phenylmethoxyphenyl)propanoate
CID 95654466
(4-phenylmethoxyphenyl)methyl 2,2-dimethylpropanoate
CID 70968645
2-methyl-2-(4-phenylmethoxyphenyl)pent-4-enoic acid
CID 21347999

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide?
The IUPAC name of N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide (CID 134113096) is N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide.
What is the SMILES notation for N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide?
The canonical SMILES for N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide is CON(C)C(=O)C(C)(C)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide?
The InChIKey is CFMUSCVGABJDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-19(2,18(21)20(3)22-4)16-10-12-17(13-11-16)23-14-15-8-6-5-7-9-15/h5-13H,14H2,1-4H3.
What are the key properties of N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide?
N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.56, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,2-dimethyl-2-(4-phenylmethoxyphenyl)propanamide is sourced from PubChem (CID 134113096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).