3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine

C10H20N4 — CID 66014379

IUPAC3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine
SMILESCCCN(C)c1c(N)c(CC)nn1C
InChIInChI=1S/C10H20N4/c1-5-7-13(3)10-9(11)8(6-2)12-14(10)4/h5-7,11H2,1-4H3
InChIKeyCIBPAARVOAUKAN-UHFFFAOYSA-N
MW196.30 g/mol
LogP1.41
Rot. Bonds4

About 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine

3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine (PubChem CID 66014379) has the molecular formula C10H20N4 and a molecular weight of 196.30 g/mol. Its IUPAC name is 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine.

Molecular Properties

Compound Name3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine
PubChem CID66014379
Molecular FormulaC10H20N4
Molecular Weight196.30 g/mol
Exact Mass196.17
IUPAC Name3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine
SMILESCCCN(C)c1c(N)c(CC)nn1C
InChIInChI=1S/C10H20N4/c1-5-7-13(3)10-9(11)8(6-2)12-14(10)4/h5-7,11H2,1-4H3
InChIKeyCIBPAARVOAUKAN-UHFFFAOYSA-N
XLogP1.41
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.30
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine?
The IUPAC name of 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine (CID 66014379) is 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine.
What is the SMILES notation for 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine?
The canonical SMILES for 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine is CCCN(C)c1c(N)c(CC)nn1C.
What is the InChIKey of 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine?
The InChIKey is CIBPAARVOAUKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4/c1-5-7-13(3)10-9(11)8(6-2)12-14(10)4/h5-7,11H2,1-4H3.
What are the key properties of 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine?
3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine has a molecular weight of 196.30 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine is sourced from PubChem (CID 66014379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).