N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide

C10H18N4O3 — CID 114031928

IUPACN-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)Nc1c(N)c(C)nn1C
InChIInChI=1S/C10H18N4O3/c1-7-9(11)10(14(2)13-7)12-8(15)6-17-5-4-16-3/h4-6,11H2,1-3H3,(H,12,15)
InChIKeyPCBQMPJTBNWOJC-UHFFFAOYSA-N
MW242.28 g/mol
LogP-0.09
Rot. Bonds6

About N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide

N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide (PubChem CID 114031928) has the molecular formula C10H18N4O3 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide
PubChem CID114031928
Molecular FormulaC10H18N4O3
Molecular Weight242.28 g/mol
Exact Mass242.14
IUPAC NameN-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)Nc1c(N)c(C)nn1C
InChIInChI=1S/C10H18N4O3/c1-7-9(11)10(14(2)13-7)12-8(15)6-17-5-4-16-3/h4-6,11H2,1-3H3,(H,12,15)
InChIKeyPCBQMPJTBNWOJC-UHFFFAOYSA-N
XLogP-0.09
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide (CID 114031928) is N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)Nc1c(N)c(C)nn1C.
What is the InChIKey of N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide?
The InChIKey is PCBQMPJTBNWOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O3/c1-7-9(11)10(14(2)13-7)12-8(15)6-17-5-4-16-3/h4-6,11H2,1-3H3,(H,12,15).
What are the key properties of N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide?
N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide has a molecular weight of 242.28 g/mol, XLogP of -0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 114031928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).