2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide

C13H22N4O — CID 18155912

IUPAC2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide
SMILESCC(C)n1nccc1NC(=O)CN1CCCCC1
InChIInChI=1S/C13H22N4O/c1-11(2)17-12(6-7-14-17)15-13(18)10-16-8-4-3-5-9-16/h6-7,11H,3-5,8-10H2,1-2H3,(H,15,18)
InChIKeyMSSFOOCIWWINCG-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.89
Rot. Bonds4

About 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide

2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide (PubChem CID 18155912) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide
PubChem CID18155912
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide
SMILESCC(C)n1nccc1NC(=O)CN1CCCCC1
InChIInChI=1S/C13H22N4O/c1-11(2)17-12(6-7-14-17)15-13(18)10-16-8-4-3-5-9-16/h6-7,11H,3-5,8-10H2,1-2H3,(H,15,18)
InChIKeyMSSFOOCIWWINCG-UHFFFAOYSA-N
XLogP1.89
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-hydroxy-4-methylazepan-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 107408192
2-(4-hydroxy-3-methylpiperidin-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 114681188
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 9205498
2-[4-[(3R)-1-methyl-2-oxoazepan-3-yl]piperidin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 95832102
1-[2-oxo-2-[(2-propan-2-ylpyrazol-3-yl)amino]ethyl]piperidine-2-carboxylic acid
CID 43441242
2-[2-(methylaminomethyl)pyrrolidin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 81491148
2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 115647959
2-(azepan-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 42913354
2-(2-oxo-1-pyridinyl)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 47106513
methyl 1-[2-oxo-2-[(2-propan-2-ylpyrazol-3-yl)amino]ethyl]pyrrolidine-2-carboxylate
CID 62026166
2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 102935920
2-[(3S)-4-(2-methoxyethyl)-3-methylpiperazin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 95322887

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
The IUPAC name of 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide (CID 18155912) is 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide is CC(C)n1nccc1NC(=O)CN1CCCCC1.
What is the InChIKey of 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
The InChIKey is MSSFOOCIWWINCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-11(2)17-12(6-7-14-17)15-13(18)10-16-8-4-3-5-9-16/h6-7,11H,3-5,8-10H2,1-2H3,(H,15,18).
What are the key properties of 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide has a molecular weight of 250.35 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide is sourced from PubChem (CID 18155912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).