2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide

C10H18N4O — CID 90104757

IUPAC2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide
SMILESCCNC(=O)C(C)(C)n1cc(N)c(C)n1
InChIInChI=1S/C10H18N4O/c1-5-12-9(15)10(3,4)14-6-8(11)7(2)13-14/h6H,5,11H2,1-4H3,(H,12,15)
InChIKeyPQPASYYESAKVIO-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.64
Rot. Bonds3

About 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide

2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide (PubChem CID 90104757) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide
PubChem CID90104757
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide
SMILESCCNC(=O)C(C)(C)n1cc(N)c(C)n1
InChIInChI=1S/C10H18N4O/c1-5-12-9(15)10(3,4)14-6-8(11)7(2)13-14/h6H,5,11H2,1-4H3,(H,12,15)
InChIKeyPQPASYYESAKVIO-UHFFFAOYSA-N
XLogP0.64
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide?
The IUPAC name of 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide (CID 90104757) is 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide.
What is the SMILES notation for 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide?
The canonical SMILES for 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide is CCNC(=O)C(C)(C)n1cc(N)c(C)n1.
What is the InChIKey of 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide?
The InChIKey is PQPASYYESAKVIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-5-12-9(15)10(3,4)14-6-8(11)7(2)13-14/h6H,5,11H2,1-4H3,(H,12,15).
What are the key properties of 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide?
2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide has a molecular weight of 210.28 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-methylpyrazol-1-yl)-N-ethyl-2-methylpropanamide is sourced from PubChem (CID 90104757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).