(4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone

C14H23N5O — CID 46278483

IUPAC(4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone
SMILESCN1CCN(C(=O)c2cn[nH]c2C2CCNCC2)CC1
InChIInChI=1S/C14H23N5O/c1-18-6-8-19(9-7-18)14(20)12-10-16-17-13(12)11-2-4-15-5-3-11/h10-11,15H,2-9H2,1H3,(H,16,17)
InChIKeyWPXDSRUXFMEXMW-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.26
Rot. Bonds2

About (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone

(4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone (PubChem CID 46278483) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone.

Molecular Properties

Compound Name(4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone
PubChem CID46278483
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name(4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone
SMILESCN1CCN(C(=O)c2cn[nH]c2C2CCNCC2)CC1
InChIInChI=1S/C14H23N5O/c1-18-6-8-19(9-7-18)14(20)12-10-16-17-13(12)11-2-4-15-5-3-11/h10-11,15H,2-9H2,1H3,(H,16,17)
InChIKeyWPXDSRUXFMEXMW-UHFFFAOYSA-N
XLogP0.26
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone?
The IUPAC name of (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone (CID 46278483) is (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone.
What is the SMILES notation for (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone?
The canonical SMILES for (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone is CN1CCN(C(=O)c2cn[nH]c2C2CCNCC2)CC1.
What is the InChIKey of (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone?
The InChIKey is WPXDSRUXFMEXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-18-6-8-19(9-7-18)14(20)12-10-16-17-13(12)11-2-4-15-5-3-11/h10-11,15H,2-9H2,1H3,(H,16,17).
What are the key properties of (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone?
(4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone has a molecular weight of 277.37 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperazin-1-yl)-(5-piperidin-4-yl-1H-pyrazol-4-yl)methanone is sourced from PubChem (CID 46278483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).