2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide

C13H23N5O — CID 71877079

IUPAC2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide
SMILESCCCn1nccc1NC(=O)N1CCN(C)CC1C
InChIInChI=1S/C13H23N5O/c1-4-7-18-12(5-6-14-18)15-13(19)17-9-8-16(3)10-11(17)2/h5-6,11H,4,7-10H2,1-3H3,(H,15,19)
InChIKeyVFORVDUUTFQEMH-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.46
Rot. Bonds3

About 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide

2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide (PubChem CID 71877079) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide
PubChem CID71877079
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide
SMILESCCCn1nccc1NC(=O)N1CCN(C)CC1C
InChIInChI=1S/C13H23N5O/c1-4-7-18-12(5-6-14-18)15-13(19)17-9-8-16(3)10-11(17)2/h5-6,11H,4,7-10H2,1-3H3,(H,15,19)
InChIKeyVFORVDUUTFQEMH-UHFFFAOYSA-N
XLogP1.46
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide (CID 71877079) is 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide is CCCn1nccc1NC(=O)N1CCN(C)CC1C.
What is the InChIKey of 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide?
The InChIKey is VFORVDUUTFQEMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-4-7-18-12(5-6-14-18)15-13(19)17-9-8-16(3)10-11(17)2/h5-6,11H,4,7-10H2,1-3H3,(H,15,19).
What are the key properties of 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide?
2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(2-propylpyrazol-3-yl)piperazine-1-carboxamide is sourced from PubChem (CID 71877079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).