2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide

C14H24N4O3 — CID 171364862

IUPAC2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide
SMILESCC(C)(C(=O)NC1CCOCC1)n1cc(OCCN)cn1
InChIInChI=1S/C14H24N4O3/c1-14(2,13(19)17-11-3-6-20-7-4-11)18-10-12(9-16-18)21-8-5-15/h9-11H,3-8,15H2,1-2H3,(H,17,19)
InChIKeyNAMCXYXVXOJMMC-UHFFFAOYSA-N
MW296.37 g/mol
LogP0.25
Rot. Bonds6

About 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide

2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide (PubChem CID 171364862) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide.

Molecular Properties

Compound Name2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide
PubChem CID171364862
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC Name2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide
SMILESCC(C)(C(=O)NC1CCOCC1)n1cc(OCCN)cn1
InChIInChI=1S/C14H24N4O3/c1-14(2,13(19)17-11-3-6-20-7-4-11)18-10-12(9-16-18)21-8-5-15/h9-11H,3-8,15H2,1-2H3,(H,17,19)
InChIKeyNAMCXYXVXOJMMC-UHFFFAOYSA-N
XLogP0.25
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-(2-Aminoethoxy)-1H-pyrazol-1-yl)-N-(3,3-difluorocyclobutyl)-2-methylpropanamide hydrochloride
CID 171364853
2-[4-(2-aminoethoxy)pyrazol-1-yl]-N-(3,3-difluorocyclobutyl)-2-methylpropanamide
CID 171364854
2-(4-ethoxypyrazol-1-yl)-N,2-dimethylpropanamide
CID 177116370
2-(1-methylpyrazol-4-yl)oxy-N-pentan-2-ylpropanamide
CID 113564733
2-(1-methylpyrazol-4-yl)oxy-N-(oxan-4-yl)acetamide
CID 113564753
Methyl 2-acetamido-3-(1-propylpyrazol-4-yl)oxypropanoate
CID 113565559
N-(3-aminopropyl)-3-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide
CID 113565671
N-[2-(1-propylpyrazol-4-yl)oxyethyl]oxan-4-amine
CID 113566130
N-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]oxan-4-amine
CID 113566148
2-(1-ethylpyrazol-4-yl)oxy-N-pentan-2-ylpropanamide
CID 113566211
2-(1-ethylpyrazol-4-yl)oxy-N-(oxan-4-yl)acetamide
CID 113566212
2-(1-ethylpyrazol-4-yl)oxy-N-(1-methoxypropan-2-yl)acetamide
CID 113566253

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide?
The IUPAC name of 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide (CID 171364862) is 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide.
What is the SMILES notation for 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide?
The canonical SMILES for 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide is CC(C)(C(=O)NC1CCOCC1)n1cc(OCCN)cn1.
What is the InChIKey of 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide?
The InChIKey is NAMCXYXVXOJMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-14(2,13(19)17-11-3-6-20-7-4-11)18-10-12(9-16-18)21-8-5-15/h9-11H,3-8,15H2,1-2H3,(H,17,19).
What are the key properties of 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide?
2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide has a molecular weight of 296.37 g/mol, XLogP of 0.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminoethoxy)pyrazol-1-yl]-2-methyl-N-(oxan-4-yl)propanamide is sourced from PubChem (CID 171364862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).