5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine

C14H27N5 — CID 66018899

IUPAC5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine
SMILESCCCc1nn(C)c(N2CCN(C)C(CC)C2)c1N
InChIInChI=1S/C14H27N5/c1-5-7-12-13(15)14(18(4)16-12)19-9-8-17(3)11(6-2)10-19/h11H,5-10,15H2,1-4H3
InChIKeyATIRCUGXZZKKNB-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.49
Rot. Bonds4

About 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine

5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine (PubChem CID 66018899) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine.

Molecular Properties

Compound Name5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine
PubChem CID66018899
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine
SMILESCCCc1nn(C)c(N2CCN(C)C(CC)C2)c1N
InChIInChI=1S/C14H27N5/c1-5-7-12-13(15)14(18(4)16-12)19-9-8-17(3)11(6-2)10-19/h11H,5-10,15H2,1-4H3
InChIKeyATIRCUGXZZKKNB-UHFFFAOYSA-N
XLogP1.49
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-Methyl-5-(4-methylpiperazin-1-yl)-3-(trifluoromethyl)pyrazol-4-amine
CID 71176960
1,3-dimethyl-5-N-propan-2-yl-5-N-(2,2,2-trifluoroethyl)pyrazole-4,5-diamine
CID 55011693
1,3-Dimethyl-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyrazol-4-amine
CID 62967525
1,3-Dimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]pyrazol-4-amine
CID 65534224
1,3-Dimethyl-5-[3-(trifluoromethyl)piperidin-1-yl]pyrazol-4-amine
CID 65534799
1-Methyl-3-propan-2-yl-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyrazol-4-amine
CID 66010770
1-ethyl-3-methyl-5-N-propan-2-yl-5-N-(2,2,2-trifluoroethyl)pyrazole-4,5-diamine
CID 66010893
1-methyl-3-propan-2-yl-5-N-(3,3,3-trifluoropropyl)pyrazole-4,5-diamine
CID 66010967
1-Ethyl-3-methyl-5-[3-(trifluoromethyl)piperidin-1-yl]pyrazol-4-amine
CID 66012483
1-Ethyl-3-methyl-5-[4-(trifluoromethyl)piperidin-1-yl]pyrazol-4-amine
CID 66012484
1-Ethyl-3-methyl-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyrazol-4-amine
CID 66013247
5-N,1-dimethyl-3-propan-2-yl-5-N-(3,3,3-trifluoropropyl)pyrazole-4,5-diamine
CID 66013324

Frequently Asked Questions

What is the IUPAC name of 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine?
The IUPAC name of 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine (CID 66018899) is 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine.
What is the SMILES notation for 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine?
The canonical SMILES for 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine is CCCc1nn(C)c(N2CCN(C)C(CC)C2)c1N.
What is the InChIKey of 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine?
The InChIKey is ATIRCUGXZZKKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-5-7-12-13(15)14(18(4)16-12)19-9-8-17(3)11(6-2)10-19/h11H,5-10,15H2,1-4H3.
What are the key properties of 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine?
5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine has a molecular weight of 265.40 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine is sourced from PubChem (CID 66018899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).