N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide

C18H17N3O3 — CID 110668555

IUPACN-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cccc(-c3cnc[nH]3)c2)c1
InChIInChI=1S/C18H17N3O3/c1-23-15-7-13(8-16(9-15)24-2)18(22)21-14-5-3-4-12(6-14)17-10-19-11-20-17/h3-11H,1-2H3,(H,19,20)(H,21,22)
InChIKeyRFZOJAMQZHSRKV-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.35
Rot. Bonds5

About N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide

N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide (PubChem CID 110668555) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide
PubChem CID110668555
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cccc(-c3cnc[nH]3)c2)c1
InChIInChI=1S/C18H17N3O3/c1-23-15-7-13(8-16(9-15)24-2)18(22)21-14-5-3-4-12(6-14)17-10-19-11-20-17/h3-11H,1-2H3,(H,19,20)(H,21,22)
InChIKeyRFZOJAMQZHSRKV-UHFFFAOYSA-N
XLogP3.35
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1H-imidazol-5-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 131951100
N-[3-(1H-imidazol-5-yl)phenyl]-1H-indole-7-carboxamide
CID 131921284
3,5-dimethoxy-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 110725637
N-[3-(1H-imidazol-5-yl)phenyl]-3,3-dimethylbutanamide
CID 110668596
3-methoxy-N-(3-phenylphenyl)benzamide
CID 798645
3,5-dimethoxy-N-[3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]benzamide
CID 46266946
3,5-dimethoxy-N-(3-pyrrol-1-ylphenyl)benzamide
CID 110726291
N-[3-(1H-imidazol-5-yl)phenyl]cyclopentanecarboxamide
CID 110668538
N-[3-[2-(4-fluoroanilino)-1,3-thiazol-4-yl]phenyl]-3,5-dimethoxybenzamide
CID 42764822
2-(4-chlorophenoxy)-N-[3-(1H-imidazol-5-yl)phenyl]acetamide
CID 110668566
1-ethyl-N-[3-(1H-imidazol-5-yl)phenyl]-3-propan-2-ylpyrazole-5-carboxamide
CID 131926620
3,5-dimethoxy-N-(3-propan-2-ylphenyl)benzamide
CID 24636290

Frequently Asked Questions

What is the IUPAC name of N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide (CID 110668555) is N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide is COc1cc(OC)cc(C(=O)Nc2cccc(-c3cnc[nH]3)c2)c1.
What is the InChIKey of N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide?
The InChIKey is RFZOJAMQZHSRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-23-15-7-13(8-16(9-15)24-2)18(22)21-14-5-3-4-12(6-14)17-10-19-11-20-17/h3-11H,1-2H3,(H,19,20)(H,21,22).
What are the key properties of N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide?
N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide has a molecular weight of 323.35 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1H-imidazol-5-yl)phenyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 110668555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).