N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide

C13H19ClN2O2 — CID 66089065

IUPACN-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide
SMILESCC(CCO)CNCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C13H19ClN2O2/c1-10(6-7-17)8-15-9-13(18)16-12-5-3-2-4-11(12)14/h2-5,10,15,17H,6-9H2,1H3,(H,16,18)
InChIKeyNJFMQVOZEWKEGN-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.89
Rot. Bonds7

About N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide

N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide (PubChem CID 66089065) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide
PubChem CID66089065
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide
SMILESCC(CCO)CNCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C13H19ClN2O2/c1-10(6-7-17)8-15-9-13(18)16-12-5-3-2-4-11(12)14/h2-5,10,15,17H,6-9H2,1H3,(H,16,18)
InChIKeyNJFMQVOZEWKEGN-UHFFFAOYSA-N
XLogP1.89
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(2-chlorophenyl)-2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
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N-(2-chlorophenyl)-2-[[1-(hydroxymethyl)cyclopropyl]methylamino]acetamide
CID 113313241
N-(2-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406571
1-(3-chloro-2-fluorophenyl)-3-(4-hydroxy-2-methylbutyl)urea
CID 111473329
2-[[2-(2-chloroanilino)-2-oxoethyl]disulfanyl]-N-(2-chlorophenyl)acetamide
CID 71330084
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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide (CID 66089065) is N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide is CC(CCO)CNCC(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide?
The InChIKey is NJFMQVOZEWKEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-10(6-7-17)8-15-9-13(18)16-12-5-3-2-4-11(12)14/h2-5,10,15,17H,6-9H2,1H3,(H,16,18).
What are the key properties of N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide?
N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide has a molecular weight of 270.76 g/mol, XLogP of 1.89, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[(4-hydroxy-2-methylbutyl)amino]acetamide is sourced from PubChem (CID 66089065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).