5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one

C10H16N4O — CID 114557867

IUPAC5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one
SMILESCCn1nccc1C1NC(=O)CCC1N
InChIInChI=1S/C10H16N4O/c1-2-14-8(5-6-12-14)10-7(11)3-4-9(15)13-10/h5-7,10H,2-4,11H2,1H3,(H,13,15)
InChIKeyJFGHZVHVSATLDV-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.18
Rot. Bonds2

About 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one

5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one (PubChem CID 114557867) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one.

Molecular Properties

Compound Name5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one
PubChem CID114557867
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one
SMILESCCn1nccc1C1NC(=O)CCC1N
InChIInChI=1S/C10H16N4O/c1-2-14-8(5-6-12-14)10-7(11)3-4-9(15)13-10/h5-7,10H,2-4,11H2,1H3,(H,13,15)
InChIKeyJFGHZVHVSATLDV-UHFFFAOYSA-N
XLogP0.18
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(5-cyclopropyl-1H-pyrazol-1-yl)propyl]-3-(1-methyl-2-piperidinyl)propanamide
CID 72867210
rac-(5R,6R)-5-amino-6-(1-methyl-1H-pyrazol-5-yl)piperidin-2-one
CID 119031223
1-methyl-3-(2-methylpyrazol-3-yl)-N-(2-sulfanylethyl)piperidine-4-carboxamide
CID 177680231
N-[6-oxo-2-(2-propan-2-ylpyrazol-3-yl)piperidin-3-yl]-3-sulfanylpropanamide
CID 177681114
3-(1-methyl-2-piperidinyl)-N-{2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}propanamide
CID 72899761
({1-[3-(1-methyl-1H-pyrazol-5-yl)propanoyl]piperidin-2-yl}methyl)amine
CID 74232084
N-(cis-4-aminocyclohexyl)-3-(1-methyl-1H-pyrazol-5-yl)propanamide
CID 74237079
3-(1-methyl-1H-pyrazol-5-yl)-N-(piperidin-3-ylmethyl)propanamide
CID 74239540
3-(1-methyl-1H-pyrazol-5-yl)-N-{2-[(2S)-pyrrolidin-2-yl]ethyl}propanamide
CID 74239729
N-methyl-3-(1-methyl-1H-pyrazol-5-yl)-N-piperidin-4-ylpropanamide
CID 74248641
3-(1-methyl-1H-pyrazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 77094962
N-[1-(1-methyl-1H-pyrazol-5-yl)propyl]-4-pyrrolidin-1-ylbutanamide
CID 91770366

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one?
The IUPAC name of 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one (CID 114557867) is 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one.
What is the SMILES notation for 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one?
The canonical SMILES for 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one is CCn1nccc1C1NC(=O)CCC1N.
What is the InChIKey of 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one?
The InChIKey is JFGHZVHVSATLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-2-14-8(5-6-12-14)10-7(11)3-4-9(15)13-10/h5-7,10H,2-4,11H2,1H3,(H,13,15).
What are the key properties of 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one?
5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one has a molecular weight of 208.26 g/mol, XLogP of 0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(2-ethylpyrazol-3-yl)piperidin-2-one is sourced from PubChem (CID 114557867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).