N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine

C11H17N5 — CID 122166580

IUPACN-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine
SMILESCCn1ccc(CNc2c(C)cnn2C)n1
InChIInChI=1S/C11H17N5/c1-4-16-6-5-10(14-16)8-12-11-9(2)7-13-15(11)3/h5-7,12H,4,8H2,1-3H3
InChIKeyJNBRBOMDSSFARF-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.56
Rot. Bonds4

About N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine

N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine (PubChem CID 122166580) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine
PubChem CID122166580
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine
SMILESCCn1ccc(CNc2c(C)cnn2C)n1
InChIInChI=1S/C11H17N5/c1-4-16-6-5-10(14-16)8-12-11-9(2)7-13-15(11)3/h5-7,12H,4,8H2,1-3H3
InChIKeyJNBRBOMDSSFARF-UHFFFAOYSA-N
XLogP1.56
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine?
The IUPAC name of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine (CID 122166580) is N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine.
What is the SMILES notation for N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine?
The canonical SMILES for N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine is CCn1ccc(CNc2c(C)cnn2C)n1.
What is the InChIKey of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine?
The InChIKey is JNBRBOMDSSFARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-4-16-6-5-10(14-16)8-12-11-9(2)7-13-15(11)3/h5-7,12H,4,8H2,1-3H3.
What are the key properties of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine?
N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine has a molecular weight of 219.29 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine is sourced from PubChem (CID 122166580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).