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

C11H17N5 — CID 122166579

IUPACN-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine
SMILESCCn1ccc(CNc2nn(C)cc2C)n1
InChIInChI=1S/C11H17N5/c1-4-16-6-5-10(13-16)7-12-11-9(2)8-15(3)14-11/h5-6,8H,4,7H2,1-3H3,(H,12,14)
InChIKeyZOYCJCKUJAOQDN-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.56
Rot. Bonds4

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

N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine (PubChem CID 122166579) 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-3-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine
PubChem CID122166579
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine
SMILESCCn1ccc(CNc2nn(C)cc2C)n1
InChIInChI=1S/C11H17N5/c1-4-16-6-5-10(13-16)7-12-11-9(2)8-15(3)14-11/h5-6,8H,4,7H2,1-3H3,(H,12,14)
InChIKeyZOYCJCKUJAOQDN-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

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Related Compounds

1-ethyl-4-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazol-3-amine;hydrochloride
CID 126965584
N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-5-amine
CID 122166580
N-[(1-ethylpyrazol-3-yl)methyl]-2,5-dimethylpyrazol-3-amine;hydrochloride
CID 126966462
N-[(1-ethylpyrazol-3-yl)methyl]-2,4-dimethylaniline
CID 19619205
N-[(1-ethylpyrazol-3-yl)methyl]-3-methyl-1-propylpyrazol-4-amine;hydrochloride
CID 126966840
N-[(1-ethylpyrazol-3-yl)methyl]-5-fluoro-2-methylaniline
CID 19619230
2-[3-[(1-ethylpyrazol-3-yl)methylamino]pyrazol-1-yl]ethanol
CID 122166587
1,4-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-3-amine
CID 122166497
N-[(1-ethylpyrazol-3-yl)methyl]-2-methoxy-5-methylaniline
CID 19619216
N-[(2-methoxyphenyl)methyl]-1,4-dimethylpyrazol-3-amine
CID 122168805
1-(1-ethyl-3-methylpyrazol-4-yl)-N-[(1-ethylpyrazol-3-yl)methyl]ethanamine
CID 19625650
N-[(1-ethylpyrazol-3-yl)methyl]-2-methylbenzamide
CID 4865656

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine?
The IUPAC name of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine (CID 122166579) is N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine.
What is the SMILES notation for N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine?
The canonical SMILES for N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine is CCn1ccc(CNc2nn(C)cc2C)n1.
What is the InChIKey of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine?
The InChIKey is ZOYCJCKUJAOQDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-4-16-6-5-10(13-16)7-12-11-9(2)8-15(3)14-11/h5-6,8H,4,7H2,1-3H3,(H,12,14).
What are the key properties of N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-amine?
N-[(1-ethylpyrazol-3-yl)methyl]-1,4-dimethylpyrazol-3-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-3-amine is sourced from PubChem (CID 122166579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).