2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide

C16H24N2O3 — CID 124889974

IUPAC2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide
SMILESCC(=O)Nc1ccccc1CC(=O)NCC[C@@H](O)C(C)C
InChIInChI=1S/C16H24N2O3/c1-11(2)15(20)8-9-17-16(21)10-13-6-4-5-7-14(13)18-12(3)19/h4-7,11,15,20H,8-10H2,1-3H3,(H,17,21)(H,18,19)/t15-/m1/s1
InChIKeyLDPXURPDYYWFSP-OAHLLOKOSA-N
MW292.38 g/mol
LogP1.71
Rot. Bonds7

About 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide

2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide (PubChem CID 124889974) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide.

Molecular Properties

Compound Name2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide
PubChem CID124889974
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide
SMILESCC(=O)Nc1ccccc1CC(=O)NCC[C@@H](O)C(C)C
InChIInChI=1S/C16H24N2O3/c1-11(2)15(20)8-9-17-16(21)10-13-6-4-5-7-14(13)18-12(3)19/h4-7,11,15,20H,8-10H2,1-3H3,(H,17,21)(H,18,19)/t15-/m1/s1
InChIKeyLDPXURPDYYWFSP-OAHLLOKOSA-N
XLogP1.71
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxy-4-methylpentyl)-2-(2-hydroxyphenyl)acetamide
CID 111662196
1-[(2-ethylphenyl)methyl]-3-(3-hydroxy-4-methylpentyl)urea
CID 111506740
N-(3-hydroxy-4-methylpentyl)-N'-(2-methylphenyl)oxamide
CID 111490774
N-[2-(2-methylprop-2-enyl)phenyl]acetamide
CID 102600118
N-(3-hydroxy-4-methylpentyl)-N'-phenyloxamide
CID 111461297
1-(3-hydroxy-4-methylpentyl)-3-(2-pyrrolidin-1-ylphenyl)urea
CID 111473354
2-(1,2-benzoxazol-3-yl)-N-(3-hydroxy-4-methylpentyl)acetamide
CID 111461213
N-(3-aminobutyl)-2-(2-hydroxyphenyl)acetamide
CID 80741503
2-(2-acetamidophenyl)ethanethioic S-acid
CID 21276599
2-[(2-acetamidophenyl)methylamino]-3-methylbutanoic acid
CID 66419829
1-(2-chloro-3-pyridinyl)-3-(3-hydroxy-4-methylpentyl)urea
CID 111486854
N-(3-hydroxy-4-methylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 111460901

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide?
The IUPAC name of 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide (CID 124889974) is 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide.
What is the SMILES notation for 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide?
The canonical SMILES for 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide is CC(=O)Nc1ccccc1CC(=O)NCC[C@@H](O)C(C)C.
What is the InChIKey of 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide?
The InChIKey is LDPXURPDYYWFSP-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(2)15(20)8-9-17-16(21)10-13-6-4-5-7-14(13)18-12(3)19/h4-7,11,15,20H,8-10H2,1-3H3,(H,17,21)(H,18,19)/t15-/m1/s1.
What are the key properties of 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide?
2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.71, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamidophenyl)-N-[(3R)-3-hydroxy-4-methylpentyl]acetamide is sourced from PubChem (CID 124889974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).