2-[2-(benzylcarbamoylamino)phenyl]acetamide

C16H17N3O2 — CID 51080430

IUPAC2-[2-(benzylcarbamoylamino)phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC(=O)NCc1ccccc1
InChIInChI=1S/C16H17N3O2/c17-15(20)10-13-8-4-5-9-14(13)19-16(21)18-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,17,20)(H2,18,19,21)
InChIKeyXBLUOTVBEUTUHI-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.04
Rot. Bonds5

About 2-[2-(benzylcarbamoylamino)phenyl]acetamide

2-[2-(benzylcarbamoylamino)phenyl]acetamide (PubChem CID 51080430) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-[2-(benzylcarbamoylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-[2-(benzylcarbamoylamino)phenyl]acetamide
PubChem CID51080430
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name2-[2-(benzylcarbamoylamino)phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC(=O)NCc1ccccc1
InChIInChI=1S/C16H17N3O2/c17-15(20)10-13-8-4-5-9-14(13)19-16(21)18-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,17,20)(H2,18,19,21)
InChIKeyXBLUOTVBEUTUHI-UHFFFAOYSA-N
XLogP2.04
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(furan-3-ylmethylcarbamoylamino)phenyl]acetamide
CID 47039420
2-[2-[[4-(diethylaminomethyl)phenyl]methylcarbamoylamino]phenyl]acetamide
CID 86988845
1-(2-aminophenyl)-3-benzylurea
CID 86135193
2-[2-(pyridin-3-ylmethylcarbamoylamino)phenyl]acetic acid
CID 62534222
N-[2-[[2-(2-amino-2-oxoethyl)phenyl]carbamoylamino]ethyl]-2-methylpropanamide
CID 51080425
1-benzyl-3-[2-[(E)-N'-hydroxycarbamimidoyl]phenyl]urea
CID 107654444
1-benzyl-3-(2-methylsulfanylphenyl)urea
CID 47125363
1-benzyl-3-[2-(dimethylamino)phenyl]urea
CID 47202175
N-methyl-2-[2-[(4-methylphenyl)methylcarbamoylamino]phenyl]acetamide
CID 47033746
3-(benzylcarbamoylamino)-2-hydroxybenzoic acid
CID 104833448
1-[(4-fluorophenyl)methyl]-3-[2-(phenoxymethyl)phenyl]urea
CID 60544437
1-(4-amino-2-hydroxyphenyl)-3-benzylurea
CID 15553207

Frequently Asked Questions

What is the IUPAC name of 2-[2-(benzylcarbamoylamino)phenyl]acetamide?
The IUPAC name of 2-[2-(benzylcarbamoylamino)phenyl]acetamide (CID 51080430) is 2-[2-(benzylcarbamoylamino)phenyl]acetamide.
What is the SMILES notation for 2-[2-(benzylcarbamoylamino)phenyl]acetamide?
The canonical SMILES for 2-[2-(benzylcarbamoylamino)phenyl]acetamide is NC(=O)Cc1ccccc1NC(=O)NCc1ccccc1.
What is the InChIKey of 2-[2-(benzylcarbamoylamino)phenyl]acetamide?
The InChIKey is XBLUOTVBEUTUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c17-15(20)10-13-8-4-5-9-14(13)19-16(21)18-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,17,20)(H2,18,19,21).
What are the key properties of 2-[2-(benzylcarbamoylamino)phenyl]acetamide?
2-[2-(benzylcarbamoylamino)phenyl]acetamide has a molecular weight of 283.33 g/mol, XLogP of 2.04, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(benzylcarbamoylamino)phenyl]acetamide is sourced from PubChem (CID 51080430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).