2-(3-amino-N,5-dimethylanilino)acetamide

C10H15N3O — CID 112647128

IUPAC2-(3-amino-N,5-dimethylanilino)acetamide
SMILESCc1cc(N)cc(N(C)CC(N)=O)c1
InChIInChI=1S/C10H15N3O/c1-7-3-8(11)5-9(4-7)13(2)6-10(12)14/h3-5H,6,11H2,1-2H3,(H2,12,14)
InChIKeyVKFQIKMNVRYTIY-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.50
Rot. Bonds3

About 2-(3-amino-N,5-dimethylanilino)acetamide

2-(3-amino-N,5-dimethylanilino)acetamide (PubChem CID 112647128) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-(3-amino-N,5-dimethylanilino)acetamide.

Molecular Properties

Compound Name2-(3-amino-N,5-dimethylanilino)acetamide
PubChem CID112647128
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-(3-amino-N,5-dimethylanilino)acetamide
SMILESCc1cc(N)cc(N(C)CC(N)=O)c1
InChIInChI=1S/C10H15N3O/c1-7-3-8(11)5-9(4-7)13(2)6-10(12)14/h3-5H,6,11H2,1-2H3,(H2,12,14)
InChIKeyVKFQIKMNVRYTIY-UHFFFAOYSA-N
XLogP0.50
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-amino-N-methyl-5-sulfamoylanilino)acetamide
CID 54887797
2-(3-amino-N,5-dimethylanilino)ethanol
CID 112647088
N-carbamoyl-2-(N,3,5-trimethylanilino)acetamide
CID 47294515
2-(N,3,5-trimethylanilino)acetohydrazide
CID 63583846
2-(3-amino-N-methyl-5-sulfamoylanilino)-N,N-dimethylacetamide
CID 54887799
2-[3-amino-N-(2-hydroxyethyl)-5-methylanilino]ethanol
CID 112647279
3-N-tert-butyl-3-N,5-dimethylbenzene-1,3-diamine
CID 127003861
2-[(6-amino-3-pyridinyl)-methylamino]acetamide
CID 43374025
N-[2-(chloromethyl)prop-2-enyl]-N,3,5-trimethylaniline
CID 103067794
2-[(3-amino-5-methylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 61115052
3-N-[(2-bromophenyl)methyl]-3-N,5-dimethylbenzene-1,3-diamine
CID 112647329
1-(1-methylpyrrol-2-yl)-2-(N,3,5-trimethylanilino)ethanone
CID 61036154

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-N,5-dimethylanilino)acetamide?
The IUPAC name of 2-(3-amino-N,5-dimethylanilino)acetamide (CID 112647128) is 2-(3-amino-N,5-dimethylanilino)acetamide.
What is the SMILES notation for 2-(3-amino-N,5-dimethylanilino)acetamide?
The canonical SMILES for 2-(3-amino-N,5-dimethylanilino)acetamide is Cc1cc(N)cc(N(C)CC(N)=O)c1.
What is the InChIKey of 2-(3-amino-N,5-dimethylanilino)acetamide?
The InChIKey is VKFQIKMNVRYTIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-7-3-8(11)5-9(4-7)13(2)6-10(12)14/h3-5H,6,11H2,1-2H3,(H2,12,14).
What are the key properties of 2-(3-amino-N,5-dimethylanilino)acetamide?
2-(3-amino-N,5-dimethylanilino)acetamide has a molecular weight of 193.25 g/mol, XLogP of 0.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-N,5-dimethylanilino)acetamide is sourced from PubChem (CID 112647128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).