1-(1-methylpyrazol-4-yl)-3-propylpiperazine

C11H20N4 — CID 64925636

IUPAC1-(1-methylpyrazol-4-yl)-3-propylpiperazine
SMILESCCCC1CN(c2cnn(C)c2)CCN1
InChIInChI=1S/C11H20N4/c1-3-4-10-8-15(6-5-12-10)11-7-13-14(2)9-11/h7,9-10,12H,3-6,8H2,1-2H3
InChIKeySJWBENKUWFMEPU-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.00
Rot. Bonds3

About 1-(1-methylpyrazol-4-yl)-3-propylpiperazine

1-(1-methylpyrazol-4-yl)-3-propylpiperazine (PubChem CID 64925636) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-(1-methylpyrazol-4-yl)-3-propylpiperazine.

Molecular Properties

Compound Name1-(1-methylpyrazol-4-yl)-3-propylpiperazine
PubChem CID64925636
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-(1-methylpyrazol-4-yl)-3-propylpiperazine
SMILESCCCC1CN(c2cnn(C)c2)CCN1
InChIInChI=1S/C11H20N4/c1-3-4-10-8-15(6-5-12-10)11-7-13-14(2)9-11/h7,9-10,12H,3-6,8H2,1-2H3
InChIKeySJWBENKUWFMEPU-UHFFFAOYSA-N
XLogP1.00
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(2-methoxyethyl)pyrazol-4-yl]-3-propyl-1,4-diazepane
CID 64944621
1-(4-bromophenyl)-3-propylpiperazine
CID 64925281
1-(4-chlorophenyl)-3-propylpiperazine
CID 64925256
1-(3,4-difluorophenyl)-3-propylpiperazine
CID 64923821
1-[2-(1-methylpyrazol-4-yl)ethyl]-3-propyl-1,4-diazepane
CID 103016702
1-(3-bromo-4-iodophenyl)-3-propylpiperazine
CID 114262416
N,N,2-trimethyl-5-(3-propylpiperazin-1-yl)aniline
CID 115379367
3-propyl-1-[3-(trifluoromethyl)phenyl]piperazine
CID 64924394
1-(2,4-difluorophenyl)-3-propylpiperazine
CID 64925789
1-(1-methylpyrazol-4-yl)-3-phenyl-1,4-diazepane
CID 64943935
1-(5-bromo-2,4-difluorophenyl)-3-propylpiperazine
CID 102855240
1-(1,3-dimethylpyrazol-4-yl)-3-ethylpiperazine
CID 102807589

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrazol-4-yl)-3-propylpiperazine?
The IUPAC name of 1-(1-methylpyrazol-4-yl)-3-propylpiperazine (CID 64925636) is 1-(1-methylpyrazol-4-yl)-3-propylpiperazine.
What is the SMILES notation for 1-(1-methylpyrazol-4-yl)-3-propylpiperazine?
The canonical SMILES for 1-(1-methylpyrazol-4-yl)-3-propylpiperazine is CCCC1CN(c2cnn(C)c2)CCN1.
What is the InChIKey of 1-(1-methylpyrazol-4-yl)-3-propylpiperazine?
The InChIKey is SJWBENKUWFMEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-3-4-10-8-15(6-5-12-10)11-7-13-14(2)9-11/h7,9-10,12H,3-6,8H2,1-2H3.
What are the key properties of 1-(1-methylpyrazol-4-yl)-3-propylpiperazine?
1-(1-methylpyrazol-4-yl)-3-propylpiperazine has a molecular weight of 208.31 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrazol-4-yl)-3-propylpiperazine is sourced from PubChem (CID 64925636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).