4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide

C9H16N4O2 — CID 65356980

IUPAC4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)NCCOC
InChIInChI=1S/C9H16N4O2/c1-3-13-8(7(10)6-12-13)9(14)11-4-5-15-2/h6H,3-5,10H2,1-2H3,(H,11,14)
InChIKeyWVVIQUCSLJTALF-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.14
Rot. Bonds5

About 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide

4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide (PubChem CID 65356980) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide
PubChem CID65356980
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)NCCOC
InChIInChI=1S/C9H16N4O2/c1-3-13-8(7(10)6-12-13)9(14)11-4-5-15-2/h6H,3-5,10H2,1-2H3,(H,11,14)
InChIKeyWVVIQUCSLJTALF-UHFFFAOYSA-N
XLogP-0.14
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(4-amino-1-ethylpyrazole-5-carbonyl)amino]ethyl carbamate
CID 83202536
4-amino-1-(2-fluoroethyl)-N-(2-methoxyethyl)pyrazole-5-carboxamide
CID 132586745
4-amino-1-ethyl-N-[2-(3-methylbutoxy)ethyl]pyrazole-5-carboxamide
CID 65359199
4-amino-1-ethyl-N-(3-methylsulfanylpropyl)pyrazole-5-carboxamide
CID 65359115
4-amino-1-ethyl-N-[2-(3-methylphenoxy)ethyl]pyrazole-5-carboxamide
CID 65358711
4-amino-N-[2-(3,5-difluorophenyl)ethyl]-1-ethylpyrazole-5-carboxamide
CID 65358766
4-amino-N-[2-(4-chloropyrazol-1-yl)ethyl]-1-ethylpyrazole-5-carboxamide
CID 19620445
4-amino-1-ethyl-N-[2-(triazol-1-yl)ethyl]pyrazole-5-carboxamide
CID 113412354
4-amino-1-ethyl-N-(2-morpholin-4-ylethyl)pyrazole-5-carboxamide
CID 65357279
4-amino-N-cyclopropyl-1-ethylpyrazole-5-carboxamide
CID 65356982
4-bromo-1-ethyl-N-(3-methoxypropyl)pyrazole-5-carboxamide
CID 19476830
4-amino-1-ethyl-N-[2-(1-methylimidazol-2-yl)ethyl]pyrazole-5-carboxamide
CID 65359190

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide (CID 65356980) is 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide is CCn1ncc(N)c1C(=O)NCCOC.
What is the InChIKey of 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide?
The InChIKey is WVVIQUCSLJTALF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-3-13-8(7(10)6-12-13)9(14)11-4-5-15-2/h6H,3-5,10H2,1-2H3,(H,11,14).
What are the key properties of 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide?
4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide has a molecular weight of 212.25 g/mol, XLogP of -0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide is sourced from PubChem (CID 65356980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).