4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide

C15H25N5O2 — CID 154781611

IUPAC4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
SMILESCCc1nn(C)cc1NC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C15H25N5O2/c1-5-12-13(10-19(4)17-12)16-14(21)11-6-8-20(9-7-11)15(22)18(2)3/h10-11H,5-9H2,1-4H3,(H,16,21)
InChIKeyKLNUNSLRQLQJEQ-UHFFFAOYSA-N
MW307.40 g/mol
LogP1.31
Rot. Bonds3

About 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide

4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide (PubChem CID 154781611) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
PubChem CID154781611
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC Name4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
SMILESCCc1nn(C)cc1NC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C15H25N5O2/c1-5-12-13(10-19(4)17-12)16-14(21)11-6-8-20(9-7-11)15(22)18(2)3/h10-11H,5-9H2,1-4H3,(H,16,21)
InChIKeyKLNUNSLRQLQJEQ-UHFFFAOYSA-N
XLogP1.31
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
CID 103908575
2-[(3-ethyl-1-methylpyrazol-4-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 107462239
4-N-[2-(ethylaminomethyl)phenyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide;hydrochloride
CID 119439439
4-N-(2-aminophenyl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide;hydrochloride
CID 119422188
N-(3-ethyl-1-methylpyrazol-4-yl)-6-methylpiperidine-2-carboxamide
CID 107463362
1-[2-[[1-(dimethylcarbamoyl)piperidine-4-carbonyl]amino]phenyl]pyrazole-3-carboxylic acid
CID 119206700
4-amino-N-(3-ethyl-1-methylpyrazol-4-yl)cyclopent-2-ene-1-carboxamide
CID 107463151
4-N-(3,5-dimethylphenyl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 56923353
1-N,1-N-dimethyl-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide
CID 47136046
4-N-(4-bromo-2-methylphenyl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 56922800
4-N-[4-[(2R)-butan-2-yl]phenyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 94858106
1-[(3-ethyl-1-methylpyrazol-4-yl)sulfamoyl]piperidine-4-carboxylic acid
CID 107462266

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide (CID 154781611) is 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide is CCc1nn(C)cc1NC(=O)C1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
The InChIKey is KLNUNSLRQLQJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-5-12-13(10-19(4)17-12)16-14(21)11-6-8-20(9-7-11)15(22)18(2)3/h10-11H,5-9H2,1-4H3,(H,16,21).
What are the key properties of 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide?
4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide has a molecular weight of 307.40 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 154781611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).