N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide

C24H27N3O2 — CID 46042373

IUPACN-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide
SMILESCCc1nn(-c2ccccc2)c(Oc2cccc(C)c2)c1CCC(=O)NC1CC1
InChIInChI=1S/C24H27N3O2/c1-3-22-21(14-15-23(28)25-18-12-13-18)24(29-20-11-7-8-17(2)16-20)27(26-22)19-9-5-4-6-10-19/h4-11,16,18H,3,12-15H2,1-2H3,(H,25,28)
InChIKeyLPANRJWDAMWUMS-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.75
Rot. Bonds8

About N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide

N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide (PubChem CID 46042373) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide
PubChem CID46042373
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC NameN-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide
SMILESCCc1nn(-c2ccccc2)c(Oc2cccc(C)c2)c1CCC(=O)NC1CC1
InChIInChI=1S/C24H27N3O2/c1-3-22-21(14-15-23(28)25-18-12-13-18)24(29-20-11-7-8-17(2)16-20)27(26-22)19-9-5-4-6-10-19/h4-11,16,18H,3,12-15H2,1-2H3,(H,25,28)
InChIKeyLPANRJWDAMWUMS-UHFFFAOYSA-N
XLogP4.75
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-3-[3-ethyl-5-(2-fluorophenoxy)-1-phenylpyrazol-4-yl]propanamide
CID 42850402
3-[3-ethyl-1-(4-methoxyphenyl)-5-(3-methylphenoxy)pyrazol-4-yl]-N-(4-methylphenyl)propanamide
CID 42850467
3-[3-ethyl-5-(4-methylphenoxy)-1-phenylpyrazol-4-yl]-N-(3-fluorophenyl)propanamide
CID 42850393
3-[3-ethyl-5-(3-fluorophenoxy)-1-(4-methoxyphenyl)pyrazol-4-yl]-N-(3-methylphenyl)propanamide
CID 46042455
N-ethyl-3-[3-ethyl-5-(4-fluorophenoxy)-1-phenylpyrazol-4-yl]propanamide
CID 42850422
3-[3-ethyl-5-(4-fluorophenoxy)-1-phenylpyrazol-4-yl]-N-(3-fluorophenyl)propanamide
CID 42850424
N-cyclopropyl-3-[5-(4-fluorophenoxy)-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]propanamide
CID 42850586
3-[3-ethyl-5-(3-fluorophenoxy)-1-phenylpyrazol-4-yl]-N-methyl-N-propan-2-ylpropanamide
CID 42850417
3-[3-ethyl-5-(3-methoxyphenoxy)-1-(4-methoxyphenyl)pyrazol-4-yl]-N-(2-methylpropyl)propanamide
CID 42850441
[3-methyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]methanol
CID 39096917
N-ethyl-3-(3-methyl-5-phenoxy-1-phenylpyrazol-4-yl)propanamide
CID 46043085
3-[3-ethyl-5-(3-fluorophenoxy)-1-(4-methoxyphenyl)pyrazol-4-yl]-N-(3-fluorophenyl)propanamide
CID 46042454

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide (CID 46042373) is N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide is CCc1nn(-c2ccccc2)c(Oc2cccc(C)c2)c1CCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide?
The InChIKey is LPANRJWDAMWUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-3-22-21(14-15-23(28)25-18-12-13-18)24(29-20-11-7-8-17(2)16-20)27(26-22)19-9-5-4-6-10-19/h4-11,16,18H,3,12-15H2,1-2H3,(H,25,28).
What are the key properties of N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide?
N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide has a molecular weight of 389.50 g/mol, XLogP of 4.75, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[3-ethyl-5-(3-methylphenoxy)-1-phenylpyrazol-4-yl]propanamide is sourced from PubChem (CID 46042373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).