N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide

C15H26N4O — CID 134711943

IUPACN-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide
SMILESCCc1nn(C)c(NC(=O)CCN2CCCCC2)c1C
InChIInChI=1S/C15H26N4O/c1-4-13-12(2)15(18(3)17-13)16-14(20)8-11-19-9-6-5-7-10-19/h4-11H2,1-3H3,(H,16,20)
InChIKeyHRNBOVBQAXORRA-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.11
Rot. Bonds5

About N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide

N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide (PubChem CID 134711943) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide
PubChem CID134711943
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide
SMILESCCc1nn(C)c(NC(=O)CCN2CCCCC2)c1C
InChIInChI=1S/C15H26N4O/c1-4-13-12(2)15(18(3)17-13)16-14(20)8-11-19-9-6-5-7-10-19/h4-11H2,1-3H3,(H,16,20)
InChIKeyHRNBOVBQAXORRA-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide?
The IUPAC name of N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide (CID 134711943) is N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide.
What is the SMILES notation for N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide?
The canonical SMILES for N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide is CCc1nn(C)c(NC(=O)CCN2CCCCC2)c1C.
What is the InChIKey of N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide?
The InChIKey is HRNBOVBQAXORRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-13-12(2)15(18(3)17-13)16-14(20)8-11-19-9-6-5-7-10-19/h4-11H2,1-3H3,(H,16,20).
What are the key properties of N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide?
N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide has a molecular weight of 278.40 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-2,4-dimethylpyrazol-3-yl)-3-piperidin-1-ylpropanamide is sourced from PubChem (CID 134711943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).