N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide

C18H18FN3O3 — CID 122151169

IUPACN-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide
SMILESCOC(c1ccc(F)cc1)C(C)NC(=O)c1cn[nH]c1-c1ccoc1
InChIInChI=1S/C18H18FN3O3/c1-11(17(24-2)12-3-5-14(19)6-4-12)21-18(23)15-9-20-22-16(15)13-7-8-25-10-13/h3-11,17H,1-2H3,(H,20,22)(H,21,23)
InChIKeyXXMHRPMSAUEUQP-UHFFFAOYSA-N
MW343.36 g/mol
LogP3.31
Rot. Bonds6

About N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide

N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide (PubChem CID 122151169) has the molecular formula C18H18FN3O3 and a molecular weight of 343.36 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide
PubChem CID122151169
Molecular FormulaC18H18FN3O3
Molecular Weight343.36 g/mol
Exact Mass343.13
IUPAC NameN-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide
SMILESCOC(c1ccc(F)cc1)C(C)NC(=O)c1cn[nH]c1-c1ccoc1
InChIInChI=1S/C18H18FN3O3/c1-11(17(24-2)12-3-5-14(19)6-4-12)21-18(23)15-9-20-22-16(15)13-7-8-25-10-13/h3-11,17H,1-2H3,(H,20,22)(H,21,23)
InChIKeyXXMHRPMSAUEUQP-UHFFFAOYSA-N
XLogP3.31
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.36
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide 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

5-(3,4-dimethoxyphenyl)-N-[1-(4-fluorophenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 71824303
N-butan-2-yl-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 24638552
methyl 3-[5-(furan-3-yl)-1H-pyrazol-4-yl]propanoate
CID 121212621
5-(4-fluorophenyl)-N-[(1S)-1-thiophen-2-ylethyl]-1H-pyrazole-4-carboxamide
CID 25330536
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-5-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 95795144
2-(difluoromethoxy)-N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]pyridine-4-carboxamide
CID 154841281
5-(4-chlorophenyl)-N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 94049155
N-[1-(4-methoxyphenyl)ethyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide
CID 71824160
N-[(1S)-1-(4-methoxyphenyl)ethyl]-5-(4-nitrophenyl)-1H-pyrazole-4-carboxamide
CID 95795239
N-[(4-fluorophenyl)methyl]-5-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 71824635
N-[2-(dimethylamino)-2-oxo-1-phenylethyl]-5-(3-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 70737970
5-(3-bromophenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 95795174

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide (CID 122151169) is N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide is COC(c1ccc(F)cc1)C(C)NC(=O)c1cn[nH]c1-c1ccoc1.
What is the InChIKey of N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is XXMHRPMSAUEUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O3/c1-11(17(24-2)12-3-5-14(19)6-4-12)21-18(23)15-9-20-22-16(15)13-7-8-25-10-13/h3-11,17H,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide?
N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 343.36 g/mol, XLogP of 3.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)-1-methoxypropan-2-yl]-5-(furan-3-yl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 122151169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).