2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine

C14H24N4 — CID 64839337

IUPAC2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
SMILESCn1cc(CN2CC(C)(C)NCC2C2CC2)cn1
InChIInChI=1S/C14H24N4/c1-14(2)10-18(9-11-6-16-17(3)8-11)13(7-15-14)12-4-5-12/h6,8,12-13,15H,4-5,7,9-10H2,1-3H3
InChIKeyHFRMXVGMAARMLF-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.38
Rot. Bonds3

About 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine

2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine (PubChem CID 64839337) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine.

Molecular Properties

Compound Name2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
PubChem CID64839337
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
SMILESCn1cc(CN2CC(C)(C)NCC2C2CC2)cn1
InChIInChI=1S/C14H24N4/c1-14(2)10-18(9-11-6-16-17(3)8-11)13(7-15-14)12-4-5-12/h6,8,12-13,15H,4-5,7,9-10H2,1-3H3
InChIKeyHFRMXVGMAARMLF-UHFFFAOYSA-N
XLogP1.38
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine?
The IUPAC name of 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine (CID 64839337) is 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine.
What is the SMILES notation for 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine?
The canonical SMILES for 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine is Cn1cc(CN2CC(C)(C)NCC2C2CC2)cn1.
What is the InChIKey of 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine?
The InChIKey is HFRMXVGMAARMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-14(2)10-18(9-11-6-16-17(3)8-11)13(7-15-14)12-4-5-12/h6,8,12-13,15H,4-5,7,9-10H2,1-3H3.
What are the key properties of 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine?
2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine has a molecular weight of 248.37 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5,5-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine is sourced from PubChem (CID 64839337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).