(3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone

C15H25N3O2 — CID 16925363

IUPAC(3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone
SMILESCCOc1nn(CC)cc1C(=O)N1CC(C)CC(C)C1
InChIInChI=1S/C15H25N3O2/c1-5-18-10-13(14(16-18)20-6-2)15(19)17-8-11(3)7-12(4)9-17/h10-12H,5-9H2,1-4H3
InChIKeyQKZPFYSUVZFPFK-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.42
Rot. Bonds4

About (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone

(3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone (PubChem CID 16925363) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name(3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone
PubChem CID16925363
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name(3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone
SMILESCCOc1nn(CC)cc1C(=O)N1CC(C)CC(C)C1
InChIInChI=1S/C15H25N3O2/c1-5-18-10-13(14(16-18)20-6-2)15(19)17-8-11(3)7-12(4)9-17/h10-12H,5-9H2,1-4H3
InChIKeyQKZPFYSUVZFPFK-UHFFFAOYSA-N
XLogP2.42
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-Methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carbaldehyde
CID 84652336
(3-methoxy-1-methyl-1H-pyrazol-4-yl)(4-methylpiperidin-1-yl)methanone
CID 16925246
(4-(5-isopropyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl)(3-methoxy-1-methyl-1H-pyrazol-4-yl)methanone
CID 45540384
N,N-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
CID 71789423
(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
CID 71789426
3-methoxy-1-methyl-N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxamide
CID 71796128
N-Ethyl-3-methoxy-1-methyl-N-propyl-1H-pyrazole-4-carboxamide
CID 45097881
N-ethyl-1-methyl-3-(prop-2-yn-1-yloxy)-N-propyl-1H-pyrazole-4-carboxamide
CID 76334034
(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl)(piperidin-1-yl)methanone
CID 71789424
(3-methoxy-1-methyl-1H-pyrazol-4-yl)(pyrrolidin-1-yl)methanone
CID 16925244
methyl 1-(3-methoxy-1-methyl-1H-pyrazole-4-carbonyl)piperidine-4-carboxylate
CID 16925248
(3-ethoxy-1-ethyl-1H-pyrazol-4-yl)(morpholino)methanone
CID 16925364

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
The IUPAC name of (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone (CID 16925363) is (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone.
What is the SMILES notation for (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
The canonical SMILES for (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone is CCOc1nn(CC)cc1C(=O)N1CC(C)CC(C)C1.
What is the InChIKey of (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
The InChIKey is QKZPFYSUVZFPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-5-18-10-13(14(16-18)20-6-2)15(19)17-8-11(3)7-12(4)9-17/h10-12H,5-9H2,1-4H3.
What are the key properties of (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone?
(3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone has a molecular weight of 279.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylpiperidin-1-yl)-(3-ethoxy-1-ethylpyrazol-4-yl)methanone is sourced from PubChem (CID 16925363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).