3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine

C14H24N4 — CID 103016188

IUPAC3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine
SMILESCn1cc(CCN2CCNC(C)(C3CC3)C2)cn1
InChIInChI=1S/C14H24N4/c1-14(13-3-4-13)11-18(8-6-15-14)7-5-12-9-16-17(2)10-12/h9-10,13,15H,3-8,11H2,1-2H3
InChIKeyROJNGFALCBMLRB-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.04
Rot. Bonds4

About 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine

3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine (PubChem CID 103016188) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine.

Molecular Properties

Compound Name3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine
PubChem CID103016188
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine
SMILESCn1cc(CCN2CCNC(C)(C3CC3)C2)cn1
InChIInChI=1S/C14H24N4/c1-14(13-3-4-13)11-18(8-6-15-14)7-5-12-9-16-17(2)10-12/h9-10,13,15H,3-8,11H2,1-2H3
InChIKeyROJNGFALCBMLRB-UHFFFAOYSA-N
XLogP1.04
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(3-cyclopropyl-3-methylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole
CID 114185224
3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]azetidin-3-amine
CID 103015435
3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]azetidin-3-ol
CID 103014043
5-[(3-cyclopropyl-3-methylpiperazin-1-yl)methyl]-2-methyl-1,3-thiazole
CID 64925154
3-cyclopropyl-3-methyl-1-octylpiperazine
CID 64833492
3-[2-(1-methylpyrazol-4-yl)ethyl]-3,9-diazabicyclo[4.2.1]nonane
CID 103815562
4-bromo-1-[2-(1-methylpyrazol-4-yl)ethyl]piperidine
CID 103015270
8-cyclopropyl-8-methyl-6-[(1-methylpyrazol-4-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 64860600
3-cyclopropyl-3-methyl-1-(2-phenoxyethyl)piperazine
CID 64833088
2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64877873
1-[2-(1-methylpyrazol-4-yl)ethyl]-3-phenylpiperazine
CID 103016180
3-cyclopropyl-3-methyl-1-[(5-methylfuran-2-yl)methyl]piperazine
CID 64952174

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine?
The IUPAC name of 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine (CID 103016188) is 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine.
What is the SMILES notation for 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine?
The canonical SMILES for 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine is Cn1cc(CCN2CCNC(C)(C3CC3)C2)cn1.
What is the InChIKey of 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine?
The InChIKey is ROJNGFALCBMLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-14(13-3-4-13)11-18(8-6-15-14)7-5-12-9-16-17(2)10-12/h9-10,13,15H,3-8,11H2,1-2H3.
What are the key properties of 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine?
3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine has a molecular weight of 248.37 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine is sourced from PubChem (CID 103016188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).