5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine

C14H26N4 — CID 66018877

IUPAC5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(N(CC(C)C)C2CC2)c1N
InChIInChI=1S/C14H26N4/c1-5-6-12-13(15)14(17(4)16-12)18(9-10(2)3)11-7-8-11/h10-11H,5-9,15H2,1-4H3
InChIKeyZUFYRVQMGOEDEM-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.58
Rot. Bonds6

About 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine

5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine (PubChem CID 66018877) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine
PubChem CID66018877
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine
SMILESCCCc1nn(C)c(N(CC(C)C)C2CC2)c1N
InChIInChI=1S/C14H26N4/c1-5-6-12-13(15)14(17(4)16-12)18(9-10(2)3)11-7-8-11/h10-11H,5-9,15H2,1-4H3
InChIKeyZUFYRVQMGOEDEM-UHFFFAOYSA-N
XLogP2.58
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine?
The IUPAC name of 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine (CID 66018877) is 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine is CCCc1nn(C)c(N(CC(C)C)C2CC2)c1N.
What is the InChIKey of 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine?
The InChIKey is ZUFYRVQMGOEDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-5-6-12-13(15)14(17(4)16-12)18(9-10(2)3)11-7-8-11/h10-11H,5-9,15H2,1-4H3.
What are the key properties of 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine?
5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopropyl-1-methyl-5-N-(2-methylpropyl)-3-propylpyrazole-4,5-diamine is sourced from PubChem (CID 66018877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).