2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide

C12H18N2O2 — CID 43499948

IUPAC2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNC(C)CO
InChIInChI=1S/C12H18N2O2/c1-9-5-3-4-6-11(9)14-12(16)7-13-10(2)8-15/h3-6,10,13,15H,7-8H2,1-2H3,(H,14,16)
InChIKeyUNXHEZZREPCFTI-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.90
Rot. Bonds5

About 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide

2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide (PubChem CID 43499948) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide
PubChem CID43499948
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNC(C)CO
InChIInChI=1S/C12H18N2O2/c1-9-5-3-4-6-11(9)14-12(16)7-13-10(2)8-15/h3-6,10,13,15H,7-8H2,1-2H3,(H,14,16)
InChIKeyUNXHEZZREPCFTI-UHFFFAOYSA-N
XLogP0.90
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-methoxypropan-2-ylamino)-N-(2-methylphenyl)acetamide
CID 43179613
N-(2-methylphenyl)-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 61474184
2-[[2-(2-methylanilino)-2-oxoethyl]amino]-N-(2-methylpropyl)propanamide
CID 115745528
N-(2-methylphenyl)-2-(2-propan-2-ylanilino)acetamide
CID 42069296
N-(2-methylphenyl)-3-oxobutanamide
CID 7154
2-(2,3-dihydroxypropylamino)-N-(2-methylphenyl)acetamide
CID 66170580
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(2-methylphenyl)acetamide
CID 9306757
N-(2-methylphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401913
2-[[(1S)-1-(2,4-difluorophenyl)ethyl]amino]-N-(2-methylphenyl)acetamide
CID 9369627
4-hydroxy-N-(2-methylphenyl)pentanamide
CID 79017195
2-(2-acetamidophenyl)sulfanyl-N-(2-methylphenyl)acetamide
CID 126190550
(2R)-2-[[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]propanoic acid
CID 83194221

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide (CID 43499948) is 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CNC(C)CO.
What is the InChIKey of 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide?
The InChIKey is UNXHEZZREPCFTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-5-3-4-6-11(9)14-12(16)7-13-10(2)8-15/h3-6,10,13,15H,7-8H2,1-2H3,(H,14,16).
What are the key properties of 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide?
2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide has a molecular weight of 222.29 g/mol, XLogP of 0.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxypropan-2-ylamino)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 43499948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).