N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide

C12H19N3O2 — CID 75501541

IUPACN-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1cc(C2CCCC2)nn1C
InChIInChI=1S/C12H19N3O2/c1-15-11(13-12(16)8-17-2)7-10(14-15)9-5-3-4-6-9/h7,9H,3-6,8H2,1-2H3,(H,13,16)
InChIKeyIWVMCXODLMNQRX-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.66
Rot. Bonds4

About N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide

N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide (PubChem CID 75501541) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide
PubChem CID75501541
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1cc(C2CCCC2)nn1C
InChIInChI=1S/C12H19N3O2/c1-15-11(13-12(16)8-17-2)7-10(14-15)9-5-3-4-6-9/h7,9H,3-6,8H2,1-2H3,(H,13,16)
InChIKeyIWVMCXODLMNQRX-UHFFFAOYSA-N
XLogP1.66
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide?
The IUPAC name of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide (CID 75501541) is N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide.
What is the SMILES notation for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide?
The canonical SMILES for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide is COCC(=O)Nc1cc(C2CCCC2)nn1C.
What is the InChIKey of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide?
The InChIKey is IWVMCXODLMNQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-15-11(13-12(16)8-17-2)7-10(14-15)9-5-3-4-6-9/h7,9H,3-6,8H2,1-2H3,(H,13,16).
What are the key properties of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide?
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide has a molecular weight of 237.30 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxyacetamide is sourced from PubChem (CID 75501541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).