N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide

C14H22N2O — CID 108993242

IUPACN-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide
SMILESCc1cccc(NC(=O)CNCC(C)C)c1C
InChIInChI=1S/C14H22N2O/c1-10(2)8-15-9-14(17)16-13-7-5-6-11(3)12(13)4/h5-7,10,15H,8-9H2,1-4H3,(H,16,17)
InChIKeyRFWCDTNTGSLZEV-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.49
Rot. Bonds5

About N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide

N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide (PubChem CID 108993242) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide
PubChem CID108993242
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide
SMILESCc1cccc(NC(=O)CNCC(C)C)c1C
InChIInChI=1S/C14H22N2O/c1-10(2)8-15-9-14(17)16-13-7-5-6-11(3)12(13)4/h5-7,10,15H,8-9H2,1-4H3,(H,16,17)
InChIKeyRFWCDTNTGSLZEV-UHFFFAOYSA-N
XLogP2.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78908653
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide
CID 54813873
N-(2,3-dimethylphenyl)-2-hydroxyacetamide
CID 16769655
N-(2-methoxyphenyl)-2-(2-methylpropylamino)acetamide
CID 9322485
N-(2,3-dimethylphenyl)-2-(hexadecylamino)acetamide
CID 54808961
2-[acetyl(2-methylpropyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 113158912
[2-(2,3-dimethylanilino)-2-oxoethyl]-methyl-[2-(2-methylpropylcarbamoylamino)-2-oxoethyl]azanium
CID 9287497
2-[(2-bromoacetyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 55246569
methyl 3-(2,3-dimethylanilino)-3-oxopropanoate
CID 14278404
N-(2,3-dimethylphenyl)-4-oxopentanamide
CID 60636238
2-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanylacetic acid
CID 864327

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide (CID 108993242) is N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide is Cc1cccc(NC(=O)CNCC(C)C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide?
The InChIKey is RFWCDTNTGSLZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10(2)8-15-9-14(17)16-13-7-5-6-11(3)12(13)4/h5-7,10,15H,8-9H2,1-4H3,(H,16,17).
What are the key properties of N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide?
N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide has a molecular weight of 234.34 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide is sourced from PubChem (CID 108993242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).