1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine

C10H15N5 — CID 7022254

IUPAC1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine
SMILESCCn1cc(Cn2cc(N)cn2)c(C)n1
InChIInChI=1S/C10H15N5/c1-3-14-5-9(8(2)13-14)6-15-7-10(11)4-12-15/h4-5,7H,3,6,11H2,1-2H3
InChIKeyMBAPAUQUJIKTJB-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.04
Rot. Bonds3

About 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine

1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine (PubChem CID 7022254) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine
PubChem CID7022254
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine
SMILESCCn1cc(Cn2cc(N)cn2)c(C)n1
InChIInChI=1S/C10H15N5/c1-3-14-5-9(8(2)13-14)6-15-7-10(11)4-12-15/h4-5,7H,3,6,11H2,1-2H3
InChIKeyMBAPAUQUJIKTJB-UHFFFAOYSA-N
XLogP1.04
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine?
The IUPAC name of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine (CID 7022254) is 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine.
What is the SMILES notation for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine?
The canonical SMILES for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine is CCn1cc(Cn2cc(N)cn2)c(C)n1.
What is the InChIKey of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine?
The InChIKey is MBAPAUQUJIKTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-3-14-5-9(8(2)13-14)6-15-7-10(11)4-12-15/h4-5,7H,3,6,11H2,1-2H3.
What are the key properties of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine?
1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine has a molecular weight of 205.26 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine is sourced from PubChem (CID 7022254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).