3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide

C19H24F2N4O — CID 119046289

IUPAC3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide
SMILESCCn1nc(C)c(NC(=O)N2CCCC(c3cc(F)ccc3F)C2)c1C
InChIInChI=1S/C19H24F2N4O/c1-4-25-13(3)18(12(2)23-25)22-19(26)24-9-5-6-14(11-24)16-10-15(20)7-8-17(16)21/h7-8,10,14H,4-6,9,11H2,1-3H3,(H,22,26)
InChIKeyVGJFJPZCANACRZ-UHFFFAOYSA-N
MW362.42 g/mol
LogP4.21
Rot. Bonds3

About 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide

3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide (PubChem CID 119046289) has the molecular formula C19H24F2N4O and a molecular weight of 362.42 g/mol. Its IUPAC name is 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide
PubChem CID119046289
Molecular FormulaC19H24F2N4O
Molecular Weight362.42 g/mol
Exact Mass362.19
IUPAC Name3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide
SMILESCCn1nc(C)c(NC(=O)N2CCCC(c3cc(F)ccc3F)C2)c1C
InChIInChI=1S/C19H24F2N4O/c1-4-25-13(3)18(12(2)23-25)22-19(26)24-9-5-6-14(11-24)16-10-15(20)7-8-17(16)21/h7-8,10,14H,4-6,9,11H2,1-3H3,(H,22,26)
InChIKeyVGJFJPZCANACRZ-UHFFFAOYSA-N
XLogP4.21
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.42
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-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

3-(2,5-difluorophenyl)-N-(2-pyrrolidin-1-yl-3-pyridinyl)piperidine-1-carboxamide
CID 119045993
3-(2,5-difluorophenyl)-N-(2-pyrazol-1-yl-3-pyridinyl)piperidine-1-carboxamide
CID 119045992
(3S)-3-(2,5-difluorophenyl)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)piperidine-1-carboxamide
CID 124736316
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-4-methylsulfonyl-1,4-diazepane-1-carboxamide
CID 138042265
(3R)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97064402
4-[(3S)-3-(2,5-difluorophenyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 99833065
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)cyclopentanecarboxamide
CID 3564038
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(3S)-3-(1-methylbenzimidazol-2-yl)piperidin-1-yl]acetamide
CID 92626417
2-[3-[(3S)-1-[(2,5-difluorophenyl)carbamoyl]piperidin-3-yl]pyrazol-1-yl]acetic acid
CID 126438313
2-[3-[1-[(2,5-difluorophenyl)carbamoyl]piperidin-3-yl]pyrazol-1-yl]acetic acid
CID 119066597
1-N-(2,4-difluorophenyl)-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 42695569
(3S)-3-ethoxy-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]piperidine-1-carboxamide
CID 95189549

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide?
The IUPAC name of 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide (CID 119046289) is 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide.
What is the SMILES notation for 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide?
The canonical SMILES for 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide is CCn1nc(C)c(NC(=O)N2CCCC(c3cc(F)ccc3F)C2)c1C.
What is the InChIKey of 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide?
The InChIKey is VGJFJPZCANACRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F2N4O/c1-4-25-13(3)18(12(2)23-25)22-19(26)24-9-5-6-14(11-24)16-10-15(20)7-8-17(16)21/h7-8,10,14H,4-6,9,11H2,1-3H3,(H,22,26).
What are the key properties of 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide?
3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide has a molecular weight of 362.42 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-difluorophenyl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperidine-1-carboxamide is sourced from PubChem (CID 119046289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).