2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide

C11H18N4O2 — CID 114104631

IUPAC2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide
SMILESCC1OCCC1CNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C11H18N4O2/c1-8-9(2-3-17-8)4-13-11(16)7-15-6-10(12)5-14-15/h5-6,8-9H,2-4,7,12H2,1H3,(H,13,16)
InChIKeyHXUYIRQAEUJQOL-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.01
Rot. Bonds4

About 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide

2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide (PubChem CID 114104631) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide
PubChem CID114104631
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide
SMILESCC1OCCC1CNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C11H18N4O2/c1-8-9(2-3-17-8)4-13-11(16)7-15-6-10(12)5-14-15/h5-6,8-9H,2-4,7,12H2,1H3,(H,13,16)
InChIKeyHXUYIRQAEUJQOL-UHFFFAOYSA-N
XLogP0.01
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(2-methyloxolan-3-yl)acetamide
CID 82725311
2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 92632010
2-(4-aminopyrazol-1-yl)-N-(oxan-4-yl)acetamide
CID 43609571
2-(4-aminopyrazol-1-yl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 43533738
1-[2-[(2-methyloxolan-3-yl)methylamino]-2-oxoethyl]pyrrole-2-carboxylic acid
CID 114106805
2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
CID 43185729
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471
2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide
CID 113490968
2,4-diamino-N-[(2-methyloxolan-3-yl)methyl]benzamide
CID 114104632
2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 114514841
2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
CID 54955773
2-(4-aminopyrazol-1-yl)-N-[[(3S)-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl]methyl]acetamide
CID 125174227

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide (CID 114104631) is 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide is CC1OCCC1CNC(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide?
The InChIKey is HXUYIRQAEUJQOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8-9(2-3-17-8)4-13-11(16)7-15-6-10(12)5-14-15/h5-6,8-9H,2-4,7,12H2,1H3,(H,13,16).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide?
2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide has a molecular weight of 238.29 g/mol, XLogP of 0.01, 4 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-[(2-methyloxolan-3-yl)methyl]acetamide is sourced from PubChem (CID 114104631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).