N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide

C14H21NO3 — CID 71980512

IUPACN-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide
SMILESCC(O)CC(C)CNC(=O)Cc1ccccc1O
InChIInChI=1S/C14H21NO3/c1-10(7-11(2)16)9-15-14(18)8-12-5-3-4-6-13(12)17/h3-6,10-11,16-17H,7-9H2,1-2H3,(H,15,18)
InChIKeyCISDTQPSKCEUTN-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.46
Rot. Bonds6

About N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide

N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide (PubChem CID 71980512) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide
PubChem CID71980512
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC NameN-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide
SMILESCC(O)CC(C)CNC(=O)Cc1ccccc1O
InChIInChI=1S/C14H21NO3/c1-10(7-11(2)16)9-15-14(18)8-12-5-3-4-6-13(12)17/h3-6,10-11,16-17H,7-9H2,1-2H3,(H,15,18)
InChIKeyCISDTQPSKCEUTN-UHFFFAOYSA-N
XLogP1.46
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylpropyl)-2-(2-hydroxyphenyl)acetamide
CID 114302533
2-(2-hydroxyphenyl)-N-(2-methylpropyl)acetamide
CID 22947307
2-(2-hydroxyphenyl)-N-[2-(methylamino)propyl]acetamide
CID 103512690
N-(2-chloro-3-ethylpentyl)-2-(2-hydroxyphenyl)acetamide
CID 106287114
N-(4-hydroxy-2-methylpentyl)-2-pyridin-3-ylacetamide
CID 111447112
2-(3-chlorophenyl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111447713
2-(2-hydroxyphenyl)-N-[(2S)-2-methyl-3-(4-methylpiperazin-1-yl)propyl]acetamide
CID 96570196
N-(4-hydroxy-2-methylpentyl)-4-oxo-4-phenylbutanamide
CID 111447676
N-[2-[(4-hydroxy-2-methylpentyl)amino]-2-oxoethyl]-2-methylbenzamide
CID 111662203
N-(3-hydroxy-4-methylpentyl)-2-(2-hydroxyphenyl)acetamide
CID 111662196
2-(5-bromothiophen-2-yl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111447118
1-(4-hydroxy-2-methylpentyl)-3-[[2-(methoxymethyl)phenyl]methyl]urea
CID 111454390

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide (CID 71980512) is N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide is CC(O)CC(C)CNC(=O)Cc1ccccc1O.
What is the InChIKey of N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide?
The InChIKey is CISDTQPSKCEUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-10(7-11(2)16)9-15-14(18)8-12-5-3-4-6-13(12)17/h3-6,10-11,16-17H,7-9H2,1-2H3,(H,15,18).
What are the key properties of N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide?
N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide has a molecular weight of 251.33 g/mol, XLogP of 1.46, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 71980512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).