[2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone

C15H24N4O — CID 25196905

IUPAC[2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone
SMILESCC(C)N1CCN(C(=O)C2CC2c2cnn(C)c2)CC1
InChIInChI=1S/C15H24N4O/c1-11(2)18-4-6-19(7-5-18)15(20)14-8-13(14)12-9-16-17(3)10-12/h9-11,13-14H,4-8H2,1-3H3
InChIKeyOEJPPFBXSAOLTO-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.08
Rot. Bonds3

About [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone

[2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone (PubChem CID 25196905) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name[2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone
PubChem CID25196905
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone
SMILESCC(C)N1CCN(C(=O)C2CC2c2cnn(C)c2)CC1
InChIInChI=1S/C15H24N4O/c1-11(2)18-4-6-19(7-5-18)15(20)14-8-13(14)12-9-16-17(3)10-12/h9-11,13-14H,4-8H2,1-3H3
InChIKeyOEJPPFBXSAOLTO-UHFFFAOYSA-N
XLogP1.08
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
The IUPAC name of [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone (CID 25196905) is [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone.
What is the SMILES notation for [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
The canonical SMILES for [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone is CC(C)N1CCN(C(=O)C2CC2c2cnn(C)c2)CC1.
What is the InChIKey of [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
The InChIKey is OEJPPFBXSAOLTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11(2)18-4-6-19(7-5-18)15(20)14-8-13(14)12-9-16-17(3)10-12/h9-11,13-14H,4-8H2,1-3H3.
What are the key properties of [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
[2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.08, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methylpyrazol-4-yl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 25196905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).