1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine

C12H19N5 — CID 19625601

IUPAC1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine
SMILESCCn1nccc1C(C)NCc1ccnn1C
InChIInChI=1S/C12H19N5/c1-4-17-12(6-8-15-17)10(2)13-9-11-5-7-14-16(11)3/h5-8,10,13H,4,9H2,1-3H3
InChIKeyARKBALBOBKSZGP-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.49
Rot. Bonds5

About 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine

1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine (PubChem CID 19625601) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine
PubChem CID19625601
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine
SMILESCCn1nccc1C(C)NCc1ccnn1C
InChIInChI=1S/C12H19N5/c1-4-17-12(6-8-15-17)10(2)13-9-11-5-7-14-16(11)3/h5-8,10,13H,4,9H2,1-3H3
InChIKeyARKBALBOBKSZGP-UHFFFAOYSA-N
XLogP1.49
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine?
The IUPAC name of 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine (CID 19625601) is 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine.
What is the SMILES notation for 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine?
The canonical SMILES for 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine is CCn1nccc1C(C)NCc1ccnn1C.
What is the InChIKey of 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine?
The InChIKey is ARKBALBOBKSZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-4-17-12(6-8-15-17)10(2)13-9-11-5-7-14-16(11)3/h5-8,10,13H,4,9H2,1-3H3.
What are the key properties of 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine?
1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine has a molecular weight of 233.32 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpyrazol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]ethanamine is sourced from PubChem (CID 19625601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).