2-[4-(dimethylcarbamoylamino)phenyl]acetamide

C11H15N3O2 — CID 47203177

IUPAC2-[4-(dimethylcarbamoylamino)phenyl]acetamide
SMILESCN(C)C(=O)Nc1ccc(CC(N)=O)cc1
InChIInChI=1S/C11H15N3O2/c1-14(2)11(16)13-9-5-3-8(4-6-9)7-10(12)15/h3-6H,7H2,1-2H3,(H2,12,15)(H,13,16)
InChIKeyQVYZRTWSMLEULU-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.81
Rot. Bonds3

About 2-[4-(dimethylcarbamoylamino)phenyl]acetamide

2-[4-(dimethylcarbamoylamino)phenyl]acetamide (PubChem CID 47203177) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[4-(dimethylcarbamoylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-[4-(dimethylcarbamoylamino)phenyl]acetamide
PubChem CID47203177
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-[4-(dimethylcarbamoylamino)phenyl]acetamide
SMILESCN(C)C(=O)Nc1ccc(CC(N)=O)cc1
InChIInChI=1S/C11H15N3O2/c1-14(2)11(16)13-9-5-3-8(4-6-9)7-10(12)15/h3-6H,7H2,1-2H3,(H2,12,15)(H,13,16)
InChIKeyQVYZRTWSMLEULU-UHFFFAOYSA-N
XLogP0.81
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-(2-amino-2-sulfanylideneethyl)phenyl]-1,1-dimethylurea
CID 79154739
ethane;2-[4-(methylamino)phenyl]acetamide
CID 142212219
2-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 47248811
3-amino-N-[4-(2-amino-2-oxoethyl)phenyl]-2-methylpropanamide
CID 62671203
2-[4-(2-amino-2-oxoethyl)anilino]propanoic acid
CID 66173321
(4-methylphenyl)methyl N-[4-(2-amino-2-oxoethyl)phenyl]carbamate
CID 171824814
2-[4-[[4-(dimethylamino)phenyl]methylamino]phenyl]acetamide
CID 43724056
(2S)-2-amino-N-[4-(2-amino-2-oxoethyl)phenyl]pentanamide
CID 107568624
(2S)-N-[4-(2-amino-2-oxoethyl)phenyl]-2-(2,6-difluorophenyl)-2-(dimethylamino)acetamide
CID 97249858
2-[4-[[2-[4-[benzenesulfonyl(methyl)amino]phenyl]acetyl]amino]phenyl]acetamide
CID 100787401
N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 31861747
N-[4-(2-amino-2-oxoethyl)phenyl]-2-(azetidin-3-ylidene)propanamide
CID 116675629

Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylcarbamoylamino)phenyl]acetamide?
The IUPAC name of 2-[4-(dimethylcarbamoylamino)phenyl]acetamide (CID 47203177) is 2-[4-(dimethylcarbamoylamino)phenyl]acetamide.
What is the SMILES notation for 2-[4-(dimethylcarbamoylamino)phenyl]acetamide?
The canonical SMILES for 2-[4-(dimethylcarbamoylamino)phenyl]acetamide is CN(C)C(=O)Nc1ccc(CC(N)=O)cc1.
What is the InChIKey of 2-[4-(dimethylcarbamoylamino)phenyl]acetamide?
The InChIKey is QVYZRTWSMLEULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-14(2)11(16)13-9-5-3-8(4-6-9)7-10(12)15/h3-6H,7H2,1-2H3,(H2,12,15)(H,13,16).
What are the key properties of 2-[4-(dimethylcarbamoylamino)phenyl]acetamide?
2-[4-(dimethylcarbamoylamino)phenyl]acetamide has a molecular weight of 221.26 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylcarbamoylamino)phenyl]acetamide is sourced from PubChem (CID 47203177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).