4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide

C12H20N4O2 — CID 65357909

IUPAC4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)N(CCOC)C2CC2)n1
InChIInChI=1S/C12H20N4O2/c1-3-15-8-10(13)11(14-15)12(17)16(6-7-18-2)9-4-5-9/h8-9H,3-7,13H2,1-2H3
InChIKeyQQJOZEMXZWIJGA-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.74
Rot. Bonds6

About 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide

4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide (PubChem CID 65357909) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide
PubChem CID65357909
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)N(CCOC)C2CC2)n1
InChIInChI=1S/C12H20N4O2/c1-3-15-8-10(13)11(14-15)12(17)16(6-7-18-2)9-4-5-9/h8-9H,3-7,13H2,1-2H3
InChIKeyQQJOZEMXZWIJGA-UHFFFAOYSA-N
XLogP0.74
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide (CID 65357909) is 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide is CCn1cc(N)c(C(=O)N(CCOC)C2CC2)n1.
What is the InChIKey of 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide?
The InChIKey is QQJOZEMXZWIJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-15-8-10(13)11(14-15)12(17)16(6-7-18-2)9-4-5-9/h8-9H,3-7,13H2,1-2H3.
What are the key properties of 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide?
4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 0.74, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 65357909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).