2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide

C10H18N4O2 — CID 104758227

IUPAC2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide
SMILESCOC(C)(C)CNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C10H18N4O2/c1-10(2,16-3)7-12-9(15)6-14-5-8(11)4-13-14/h4-5H,6-7,11H2,1-3H3,(H,12,15)
InChIKeyBHCZODGDRATTOO-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.01
Rot. Bonds5

About 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide

2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide (PubChem CID 104758227) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide
PubChem CID104758227
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide
SMILESCOC(C)(C)CNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C10H18N4O2/c1-10(2,16-3)7-12-9(15)6-14-5-8(11)4-13-14/h4-5H,6-7,11H2,1-3H3,(H,12,15)
InChIKeyBHCZODGDRATTOO-UHFFFAOYSA-N
XLogP0.01
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-amino-1H-pyrazol-1-yl)-N-methylacetamide
CID 28065173
2-(4-amino-1H-pyrazol-1-yl)-N-cyclopropylacetamide
CID 28373958
rac-tert-butyl N-[(3R,4S)-4-(4-amino-1H-pyrazol-1-yl)oxolan-3-yl]carbamate
CID 132388300
2-(4-amino-1H-pyrazol-1-yl)-N,N-dimethylacetamide
CID 28280666
2-(4-amino-1H-pyrazol-1-yl)-1-(4-methylpiperazin-1-yl)ethan-1-one
CID 28379290
methyl 2-(4-amino-1H-pyrazol-1-yl)acetate hydrochloride
CID 45791804
tert-butyl 2-(4-amino-1H-pyrazol-1-yl)acetate
CID 61285781
1-(1-Methyl-1H-pyrazol-4-yl)-2-piperazinone
CID 64263444
tert-butyl (2-(4-amino-1H-pyrazol-1-yl)ethyl)carbamate
CID 70984316
tert-butyl (3-(4-amino-1H-pyrazol-1-yl)propyl)carbamate
CID 84728083
N-(2-acetamidoethyl)-2-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]acetamide
CID 53582922
2,2-dimethyl-N-[1-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]pyrazol-4-yl]propanamide
CID 71979170

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide (CID 104758227) is 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide is COC(C)(C)CNC(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide?
The InChIKey is BHCZODGDRATTOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-10(2,16-3)7-12-9(15)6-14-5-8(11)4-13-14/h4-5H,6-7,11H2,1-3H3,(H,12,15).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide has a molecular weight of 226.28 g/mol, XLogP of 0.01, 5 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-methoxy-2-methylpropyl)acetamide is sourced from PubChem (CID 104758227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).