1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine

C14H26N4 — CID 79353358

IUPAC1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NC2C(C)(C)C2(C)C)c1N
InChIInChI=1S/C14H26N4/c1-7-8-9-10(15)11(18(6)17-9)16-12-13(2,3)14(12,4)5/h12,16H,7-8,15H2,1-6H3
InChIKeyYCHFVPLSBJAUDL-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.80
Rot. Bonds4

About 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine

1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine (PubChem CID 79353358) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine.

Molecular Properties

Compound Name1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine
PubChem CID79353358
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine
SMILESCCCc1nn(C)c(NC2C(C)(C)C2(C)C)c1N
InChIInChI=1S/C14H26N4/c1-7-8-9-10(15)11(18(6)17-9)16-12-13(2,3)14(12,4)5/h12,16H,7-8,15H2,1-6H3
InChIKeyYCHFVPLSBJAUDL-UHFFFAOYSA-N
XLogP2.80
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine?
The IUPAC name of 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine (CID 79353358) is 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine.
What is the SMILES notation for 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine?
The canonical SMILES for 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine is CCCc1nn(C)c(NC2C(C)(C)C2(C)C)c1N.
What is the InChIKey of 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine?
The InChIKey is YCHFVPLSBJAUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-7-8-9-10(15)11(18(6)17-9)16-12-13(2,3)14(12,4)5/h12,16H,7-8,15H2,1-6H3.
What are the key properties of 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine?
1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-propyl-5-N-(2,2,3,3-tetramethylcyclopropyl)pyrazole-4,5-diamine is sourced from PubChem (CID 79353358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).