N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

C17H14ClN3O3 — CID 7556147

IUPACN-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESO=C(COc1ccc(-c2nnco2)cc1)NCc1ccc(Cl)cc1
InChIInChI=1S/C17H14ClN3O3/c18-14-5-1-12(2-6-14)9-19-16(22)10-23-15-7-3-13(4-8-15)17-21-20-11-24-17/h1-8,11H,9-10H2,(H,19,22)
InChIKeyXCHHMYZHPZURRB-UHFFFAOYSA-N
MW343.77 g/mol
LogP3.09
Rot. Bonds6

About N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (PubChem CID 7556147) has the molecular formula C17H14ClN3O3 and a molecular weight of 343.77 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
PubChem CID7556147
Molecular FormulaC17H14ClN3O3
Molecular Weight343.77 g/mol
Exact Mass343.07
IUPAC NameN-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESO=C(COc1ccc(-c2nnco2)cc1)NCc1ccc(Cl)cc1
InChIInChI=1S/C17H14ClN3O3/c18-14-5-1-12(2-6-14)9-19-16(22)10-23-15-7-3-13(4-8-15)17-21-20-11-24-17/h1-8,11H,9-10H2,(H,19,22)
InChIKeyXCHHMYZHPZURRB-UHFFFAOYSA-N
XLogP3.09
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.77
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(benzylcarbamoyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 7555973
N-methyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 8001302
2-[[2-(4-chlorophenoxy)acetyl]amino]-N-[(4-chlorophenyl)methyl]acetamide
CID 110285271
N-[(4-chlorophenyl)methyl]-2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
CID 25238051
N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
CID 809048
2-(4-chlorophenoxy)-N-[[4-(methylaminomethyl)phenyl]methyl]acetamide
CID 170046008
2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 7556131
N-benzyl-2-[4-[5-[4-[2-(benzylamino)-2-oxoethoxy]phenyl]-1,3,4-oxadiazol-2-yl]phenoxy]acetamide
CID 91356412
4-[[[2-(4-chlorophenoxy)acetyl]amino]methyl]benzoic acid
CID 17171925
N-[2-(4-chlorophenoxy)ethyl]-N-methyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 8888429
2-(4-chlorophenoxy)-N-[[4-(difluoromethoxy)phenyl]methyl]acetamide
CID 42007084
N-(3,5-difluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 42368891

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (CID 7556147) is N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is O=C(COc1ccc(-c2nnco2)cc1)NCc1ccc(Cl)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The InChIKey is XCHHMYZHPZURRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O3/c18-14-5-1-12(2-6-14)9-19-16(22)10-23-15-7-3-13(4-8-15)17-21-20-11-24-17/h1-8,11H,9-10H2,(H,19,22).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide has a molecular weight of 343.77 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is sourced from PubChem (CID 7556147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).