(2R)-N-benzyl-3-methoxy-2-methylpropanamide

C12H17NO2 — CID 12051861

IUPAC(2R)-N-benzyl-3-methoxy-2-methylpropanamide
SMILESCOC[C@@H](C)C(=O)NCc1ccccc1
InChIInChI=1S/C12H17NO2/c1-10(9-15-2)12(14)13-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)/t10-/m1/s1
InChIKeyLGERAMWGVIFEPS-SNVBAGLBSA-N
MW207.27 g/mol
LogP1.59
Rot. Bonds5

About (2R)-N-benzyl-3-methoxy-2-methylpropanamide

(2R)-N-benzyl-3-methoxy-2-methylpropanamide (PubChem CID 12051861) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is (2R)-N-benzyl-3-methoxy-2-methylpropanamide.

Molecular Properties

Compound Name(2R)-N-benzyl-3-methoxy-2-methylpropanamide
PubChem CID12051861
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name(2R)-N-benzyl-3-methoxy-2-methylpropanamide
SMILESCOC[C@@H](C)C(=O)NCc1ccccc1
InChIInChI=1S/C12H17NO2/c1-10(9-15-2)12(14)13-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)/t10-/m1/s1
InChIKeyLGERAMWGVIFEPS-SNVBAGLBSA-N
XLogP1.59
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-benzyl-2-[(2-iodoacetyl)amino]-3-methoxypropanamide
CID 172598061
N-benzyl-2-(chloromethyl)-3-methoxypropanamide
CID 143985847
2-methylpropyl (2R)-3-(benzylamino)-2-(methoxymethyl)-3-oxopropanoate
CID 141445219
2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide
CID 68649669
2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride
CID 68649668
(2S)-N-benzyl-2-[[2-(ethylamino)acetyl]amino]-3-methoxypropanamide
CID 10979254
N-benzyl-2-methylpropanamide;methane
CID 160760567
2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl N-[(2R)-1-(benzylamino)-3-methoxy-1-oxopropan-2-yl]carbamate
CID 56960724
(2S)-N-(2-methoxyethyl)-2-methyl-3-phenylpropanamide
CID 141196582
benzyl N-[(2R)-3-methoxy-1-[[4-(methoxymethyl)phenyl]methylamino]-1-oxopropan-2-yl]carbamate
CID 66870075
benzyl N-[3-methoxy-1-[[4-(methoxymethyl)phenyl]methylamino]-1-oxopropan-2-yl]carbamate
CID 77199497
N-benzyl-3-cyclopropyl-2-methylpropanamide
CID 11218218

Frequently Asked Questions

What is the IUPAC name of (2R)-N-benzyl-3-methoxy-2-methylpropanamide?
The IUPAC name of (2R)-N-benzyl-3-methoxy-2-methylpropanamide (CID 12051861) is (2R)-N-benzyl-3-methoxy-2-methylpropanamide.
What is the SMILES notation for (2R)-N-benzyl-3-methoxy-2-methylpropanamide?
The canonical SMILES for (2R)-N-benzyl-3-methoxy-2-methylpropanamide is COC[C@@H](C)C(=O)NCc1ccccc1.
What is the InChIKey of (2R)-N-benzyl-3-methoxy-2-methylpropanamide?
The InChIKey is LGERAMWGVIFEPS-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H17NO2/c1-10(9-15-2)12(14)13-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)/t10-/m1/s1.
What are the key properties of (2R)-N-benzyl-3-methoxy-2-methylpropanamide?
(2R)-N-benzyl-3-methoxy-2-methylpropanamide has a molecular weight of 207.27 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-benzyl-3-methoxy-2-methylpropanamide is sourced from PubChem (CID 12051861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).