N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide

C16H16ClNO3 — CID 63364131

IUPACN-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide
SMILESC[C@@H](O)c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1
InChIInChI=1S/C16H16ClNO3/c1-11(19)12-5-7-15(8-6-12)21-10-16(20)18-14-4-2-3-13(17)9-14/h2-9,11,19H,10H2,1H3,(H,18,20)/t11-/m1/s1
InChIKeyMTOILNIHEGKSJL-LLVKDONJSA-N
MW305.76 g/mol
LogP3.41
Rot. Bonds5

About N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide

N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide (PubChem CID 63364131) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide
PubChem CID63364131
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC NameN-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide
SMILESC[C@@H](O)c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1
InChIInChI=1S/C16H16ClNO3/c1-11(19)12-5-7-15(8-6-12)21-10-16(20)18-14-4-2-3-13(17)9-14/h2-9,11,19H,10H2,1H3,(H,18,20)/t11-/m1/s1
InChIKeyMTOILNIHEGKSJL-LLVKDONJSA-N
XLogP3.41
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(1R)-1-hydroxyethyl]phenoxy]-N-(3-methylphenyl)acetamide
CID 63364236
2-(4-acetylphenoxy)-N-(3-chlorophenyl)acetamide
CID 2709970
N-(3-chlorophenyl)-4-(4-propan-2-ylphenoxy)butanamide
CID 19207322
1-(3-chlorophenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
CID 60723574
N-(3-cyanophenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 798498
N-[3-[(1S)-1-hydroxyethyl]phenyl]-2-naphthalen-2-yloxyacetamide
CID 7314126
[2-(3-chloroanilino)-2-oxoethyl] 2-(4-ethoxyphenoxy)acetate
CID 7274004
N-(3-chlorophenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide
CID 7652748
N-(3-ethynylphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 46420198
2-[3-(1-hydroxyethyl)phenoxy]-N-(4-propan-2-ylphenyl)acetamide
CID 110884631
3-[[2-(4-chlorophenoxy)acetyl]amino]-N-propan-2-ylbenzamide
CID 17197376
N-(3-chlorophenyl)-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
CID 25237975

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide (CID 63364131) is N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide is C[C@@H](O)c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1.
What is the InChIKey of N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide?
The InChIKey is MTOILNIHEGKSJL-LLVKDONJSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-11(19)12-5-7-15(8-6-12)21-10-16(20)18-14-4-2-3-13(17)9-14/h2-9,11,19H,10H2,1H3,(H,18,20)/t11-/m1/s1.
What are the key properties of N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide?
N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide has a molecular weight of 305.76 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[4-[(1R)-1-hydroxyethyl]phenoxy]acetamide is sourced from PubChem (CID 63364131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).