(2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide

C18H20N4O3 — CID 41433363

IUPAC(2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide
SMILESNC(=O)[C@H](NC(=O)CNC(=O)NCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N4O3/c19-17(24)16(14-9-5-2-6-10-14)22-15(23)12-21-18(25)20-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2,(H2,19,24)(H,22,23)(H2,20,21,25)/t16-/m1/s1
InChIKeyYNGKSIMLNMWUCJ-MRXNPFEDSA-N
MW340.38 g/mol
LogP0.83
Rot. Bonds7

About (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide

(2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide (PubChem CID 41433363) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide
PubChem CID41433363
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC Name(2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide
SMILESNC(=O)[C@H](NC(=O)CNC(=O)NCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N4O3/c19-17(24)16(14-9-5-2-6-10-14)22-15(23)12-21-18(25)20-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2,(H2,19,24)(H,22,23)(H2,20,21,25)/t16-/m1/s1
InChIKeyYNGKSIMLNMWUCJ-MRXNPFEDSA-N
XLogP0.83
TPSA113.32 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 50.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-3-phenylpropanamide
CID 94514836
2-[[2-(benzylcarbamoylamino)acetyl]amino]acetic acid
CID 61181658
(2S)-2-phenyl-2-[[2-(propan-2-ylamino)acetyl]amino]acetamide
CID 66657978
(2R)-2-[[2-(2-fluorophenyl)acetyl]amino]-2-phenylacetamide
CID 94514859
(2R)-2-[[(1R)-2-amino-2-oxo-1-phenylethyl]amino]-N-benzylpropanamide
CID 95582096
2-(benzylcarbamoylamino)-N-[(2E)-1-(4-chlorophenyl)-2-ethenylpenta-2,4-dienyl]acetamide
CID 143631835
2-[[2-[[2-(1-adamantyl)acetyl]amino]acetyl]amino]-2-phenylacetamide
CID 51315386
2-[(2-nitrosoacetyl)amino]-2-phenylacetamide
CID 143353475
(2R)-2-[(2-naphthalen-2-ylacetyl)amino]-2-phenylacetamide
CID 42377162
N'-benzyl-2-phenylpropanediamide
CID 57080466
(2R)-2-phenyl-2-[(2-phenylacetyl)amino]acetic acid
CID 3049856
2-[[2-(3-methoxyphenyl)acetyl]amino]-2-phenylacetamide
CID 51289830

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide?
The IUPAC name of (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide (CID 41433363) is (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide?
The canonical SMILES for (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide is NC(=O)[C@H](NC(=O)CNC(=O)NCc1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide?
The InChIKey is YNGKSIMLNMWUCJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H20N4O3/c19-17(24)16(14-9-5-2-6-10-14)22-15(23)12-21-18(25)20-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2,(H2,19,24)(H,22,23)(H2,20,21,25)/t16-/m1/s1.
What are the key properties of (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide?
(2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide has a molecular weight of 340.38 g/mol, XLogP of 0.83, 7 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[2-(benzylcarbamoylamino)acetyl]amino]-2-phenylacetamide is sourced from PubChem (CID 41433363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).