N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide

C18H19N3O3 — CID 71983216

IUPACN-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide
SMILESCOCC(NC(=O)c1cccc(-n2cccn2)c1)c1ccc(C)o1
InChIInChI=1S/C18H19N3O3/c1-13-7-8-17(24-13)16(12-23-2)20-18(22)14-5-3-6-15(11-14)21-10-4-9-19-21/h3-11,16H,12H2,1-2H3,(H,20,22)
InChIKeyVGCYMGBVUWUVPU-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.89
Rot. Bonds6

About N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide

N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide (PubChem CID 71983216) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide.

Molecular Properties

Compound NameN-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide
PubChem CID71983216
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC NameN-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide
SMILESCOCC(NC(=O)c1cccc(-n2cccn2)c1)c1ccc(C)o1
InChIInChI=1S/C18H19N3O3/c1-13-7-8-17(24-13)16(12-23-2)20-18(22)14-5-3-6-15(11-14)21-10-4-9-19-21/h3-11,16H,12H2,1-2H3,(H,20,22)
InChIKeyVGCYMGBVUWUVPU-UHFFFAOYSA-N
XLogP2.89
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-3-(4-fluorophenyl)-3-[(3-pyrazol-1-ylbenzoyl)amino]propanoic acid
CID 97192648
N-(4-methoxyphenyl)-3-pyrazol-1-ylbenzamide
CID 110698189
N-[(2R)-1-methoxypropan-2-yl]-4-pyrazol-1-ylbenzamide
CID 94065165
N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-3-pyrazol-1-ylbenzamide
CID 56743823
N-[2-(4-methoxyphenyl)ethyl]-3-pyrazol-1-ylbenzamide
CID 110698153
3-[[2-methoxy-1-(5-methylfuran-2-yl)ethyl]carbamoyl]-5-nitrobenzoic acid
CID 119185523
N-[2-hydroxy-3-(2-methylpropoxy)propyl]-3-pyrazol-1-ylbenzamide
CID 111697672
N-[2-(2,5-dimethylfuran-3-yl)-2-hydroxypropyl]-3-pyrazol-1-ylbenzamide
CID 111479009
N-(3-methoxyphenyl)-3-pyrazol-1-ylbenzamide
CID 110698188
N-(1-methoxypropan-2-yl)-3-(tetrazol-1-yl)benzamide
CID 47005557
2-amino-3-methoxy-N-(3-pyrazol-1-ylphenyl)propanamide
CID 81083660
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-3-pyrazol-1-ylbenzamide
CID 111423679

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide?
The IUPAC name of N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide (CID 71983216) is N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide.
What is the SMILES notation for N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide?
The canonical SMILES for N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide is COCC(NC(=O)c1cccc(-n2cccn2)c1)c1ccc(C)o1.
What is the InChIKey of N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide?
The InChIKey is VGCYMGBVUWUVPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-13-7-8-17(24-13)16(12-23-2)20-18(22)14-5-3-6-15(11-14)21-10-4-9-19-21/h3-11,16H,12H2,1-2H3,(H,20,22).
What are the key properties of N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide?
N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide has a molecular weight of 325.37 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-1-(5-methylfuran-2-yl)ethyl]-3-pyrazol-1-ylbenzamide is sourced from PubChem (CID 71983216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).