2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide

C11H18N4O2 — CID 113490968

IUPAC2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide
SMILESCC1(NC(=O)Cn2cc(N)cn2)CCOCC1
InChIInChI=1S/C11H18N4O2/c1-11(2-4-17-5-3-11)14-10(16)8-15-7-9(12)6-13-15/h6-7H,2-5,8,12H2,1H3,(H,14,16)
InChIKeyBKVPICCFRMZQMK-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.15
Rot. Bonds3

About 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide

2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide (PubChem CID 113490968) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide
PubChem CID113490968
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide
SMILESCC1(NC(=O)Cn2cc(N)cn2)CCOCC1
InChIInChI=1S/C11H18N4O2/c1-11(2-4-17-5-3-11)14-10(16)8-15-7-9(12)6-13-15/h6-7H,2-5,8,12H2,1H3,(H,14,16)
InChIKeyBKVPICCFRMZQMK-UHFFFAOYSA-N
XLogP0.15
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(oxan-4-yl)acetamide
CID 43609571
2-(4-aminopyrazol-1-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 55081558
2-(4-aminopyrazol-1-yl)-N-[(1-methylcyclopentyl)methyl]acetamide
CID 63822540
2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
CID 43185729
2-(4-aminopyrazol-1-yl)-N-(2,2-dimethylcyclopentyl)acetamide
CID 79855019
2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 93081118
2-(4-aminopyrazol-1-yl)-N-(2-methyloxolan-3-yl)acetamide
CID 82725311
2-(4-aminopyrazol-1-yl)-1-(4-hydroxy-4-methylpiperidin-1-yl)ethanone
CID 81096183
2-(3-amino-1,2,4-triazol-1-yl)-N-(1-methylcyclopentyl)acetamide
CID 61364956
2-(4-aminopyrazol-1-yl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 43533738
N-[4-(hydroxymethyl)oxan-4-yl]-2-(4-nitropyrazol-1-yl)acetamide
CID 104630428
2-chloro-N-(4-methyloxan-4-yl)acetamide
CID 18437326

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide (CID 113490968) is 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide is CC1(NC(=O)Cn2cc(N)cn2)CCOCC1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide?
The InChIKey is BKVPICCFRMZQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-11(2-4-17-5-3-11)14-10(16)8-15-7-9(12)6-13-15/h6-7H,2-5,8,12H2,1H3,(H,14,16).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide has a molecular weight of 238.29 g/mol, XLogP of 0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide is sourced from PubChem (CID 113490968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).