N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide

C18H16ClN3O2 — CID 56791413

IUPACN-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide
SMILESO=C(Cc1cccc(O)c1)Nc1nccn1Cc1ccccc1Cl
InChIInChI=1S/C18H16ClN3O2/c19-16-7-2-1-5-14(16)12-22-9-8-20-18(22)21-17(24)11-13-4-3-6-15(23)10-13/h1-10,23H,11-12H2,(H,20,21,24)
InChIKeyJWXFIIGGTWPLGU-UHFFFAOYSA-N
MW341.80 g/mol
LogP3.47
Rot. Bonds5

About N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide

N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide (PubChem CID 56791413) has the molecular formula C18H16ClN3O2 and a molecular weight of 341.80 g/mol. Its IUPAC name is N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide
PubChem CID56791413
Molecular FormulaC18H16ClN3O2
Molecular Weight341.80 g/mol
Exact Mass341.09
IUPAC NameN-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide
SMILESO=C(Cc1cccc(O)c1)Nc1nccn1Cc1ccccc1Cl
InChIInChI=1S/C18H16ClN3O2/c19-16-7-2-1-5-14(16)12-22-9-8-20-18(22)21-17(24)11-13-4-3-6-15(23)10-13/h1-10,23H,11-12H2,(H,20,21,24)
InChIKeyJWXFIIGGTWPLGU-UHFFFAOYSA-N
XLogP3.47
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.80
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]acetamide
CID 71931046
3-amino-N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]butanamide
CID 119789659
3-[[2-[(2-chlorophenyl)methyl]imidazol-1-yl]methyl]phenol
CID 82560019
N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-hydroxycyclopentane-1-carboxamide
CID 110015849
N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(1,1-dioxothiolan-3-yl)acetamide
CID 167882561
N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-3-ethylbenzenesulfonamide
CID 100614881
2-(2-amino-2-oxoethyl)sulfanyl-N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]benzamide
CID 86958124
N-(3-chlorophenyl)-2-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]sulfanylacetamide
CID 22585503
2-(3-hydroxyphenyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 61399936
2-(3-hydroxyphenyl)-N-(4-hydroxyphenyl)acetamide
CID 61399458
2-(3-hydroxyphenyl)-N-(2-methyl-3-pyridinyl)acetamide
CID 79043394
1-amino-N-(1-benzylimidazol-2-yl)cyclopropane-1-carboxamide
CID 119738584

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide (CID 56791413) is N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide is O=C(Cc1cccc(O)c1)Nc1nccn1Cc1ccccc1Cl.
What is the InChIKey of N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide?
The InChIKey is JWXFIIGGTWPLGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O2/c19-16-7-2-1-5-14(16)12-22-9-8-20-18(22)21-17(24)11-13-4-3-6-15(23)10-13/h1-10,23H,11-12H2,(H,20,21,24).
What are the key properties of N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide?
N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide has a molecular weight of 341.80 g/mol, XLogP of 3.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 56791413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).