N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide

C15H26N4O — CID 72841184

IUPACN-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(CC(=O)NCc2cc(C)nn2C)CC1
InChIInChI=1S/C15H26N4O/c1-4-19-7-5-13(6-8-19)10-15(20)16-11-14-9-12(2)17-18(14)3/h9,13H,4-8,10-11H2,1-3H3,(H,16,20)
InChIKeyCFKWDNDLJIIVTF-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.47
Rot. Bonds5

About N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide

N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide (PubChem CID 72841184) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide
PubChem CID72841184
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(CC(=O)NCc2cc(C)nn2C)CC1
InChIInChI=1S/C15H26N4O/c1-4-19-7-5-13(6-8-19)10-15(20)16-11-14-9-12(2)17-18(14)3/h9,13H,4-8,10-11H2,1-3H3,(H,16,20)
InChIKeyCFKWDNDLJIIVTF-UHFFFAOYSA-N
XLogP1.47
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide?
The IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide (CID 72841184) is N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide is CCN1CCC(CC(=O)NCc2cc(C)nn2C)CC1.
What is the InChIKey of N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide?
The InChIKey is CFKWDNDLJIIVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-19-7-5-13(6-8-19)10-15(20)16-11-14-9-12(2)17-18(14)3/h9,13H,4-8,10-11H2,1-3H3,(H,16,20).
What are the key properties of N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide?
N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide has a molecular weight of 278.40 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-(1-ethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 72841184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).