N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide

C14H21N3O2 — CID 8772476

IUPACN-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
SMILESCNC(=O)CNCC(=O)N(C)[C@@H](C)c1ccccc1
InChIInChI=1S/C14H21N3O2/c1-11(12-7-5-4-6-8-12)17(3)14(19)10-16-9-13(18)15-2/h4-8,11,16H,9-10H2,1-3H3,(H,15,18)/t11-/m0/s1
InChIKeyIJFSZZKVKVNPRO-NSHDSACASA-N
MW263.34 g/mol
LogP0.54
Rot. Bonds6

About N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide

N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide (PubChem CID 8772476) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
PubChem CID8772476
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
SMILESCNC(=O)CNCC(=O)N(C)[C@@H](C)c1ccccc1
InChIInChI=1S/C14H21N3O2/c1-11(12-7-5-4-6-8-12)17(3)14(19)10-16-9-13(18)15-2/h4-8,11,16H,9-10H2,1-3H3,(H,15,18)/t11-/m0/s1
InChIKeyIJFSZZKVKVNPRO-NSHDSACASA-N
XLogP0.54
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-[methyl(1-phenylethyl)amino]-2-oxoethyl]amino]propanoic acid
CID 43466353
N-methyl-2-(phenylcarbamoylamino)-N-(1-phenylethyl)acetamide
CID 42928470
N-methyl-2-[(3-methyl-2-phenylbutyl)amino]acetamide
CID 107875908
3-[2-[methyl(1-phenylethyl)amino]-2-oxoethyl]sulfanylpropanoic acid
CID 43238287
2-[2-[methyl(1-phenylethyl)amino]-2-oxoethyl]sulfanylpropanoic acid
CID 43238276
methyl(1-phenylethyl)carbamic acid
CID 67062794
N-methyl-4,4-diphenylbutanamide
CID 125470248
N-[2-[[2-[[2-[[2-[[2-[[2-(methylamino)-2-oxoethyl]-[(1S)-1-phenylethyl]amino]-2-oxoethyl]-[(1S)-1-phenylethyl]amino]-2-oxoethyl]-[(1S)-1-phenylethyl]amino]-2-oxoethyl]-[(1S)-1-phenylethyl]amino]-2-oxoethyl]-[(1S)-1-phenylethyl]amino]-2-oxoethyl]-N-[(1S)-1-phenylethyl]-2-(prop-2-ynylamino)acetamide
CID 135026326
4-amino-N,3-dimethyl-N-(1-phenylethyl)butanamide
CID 81087355
N-methyl-N-(1-phenylethyl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 55410573
N-methyl-N-[(1S)-1-phenylethyl]-1-trimethylsilylformamide
CID 102208486
N-[1-(4-methoxyphenyl)ethyl]-N-methyl-2-(methylamino)acetamide
CID 119704697

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide?
The IUPAC name of N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide (CID 8772476) is N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide.
What is the SMILES notation for N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide?
The canonical SMILES for N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide is CNC(=O)CNCC(=O)N(C)[C@@H](C)c1ccccc1.
What is the InChIKey of N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide?
The InChIKey is IJFSZZKVKVNPRO-NSHDSACASA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11(12-7-5-4-6-8-12)17(3)14(19)10-16-9-13(18)15-2/h4-8,11,16H,9-10H2,1-3H3,(H,15,18)/t11-/m0/s1.
What are the key properties of N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide?
N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide has a molecular weight of 263.34 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[2-[methyl-[(1S)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 8772476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).