2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide

C10H19N5O2 — CID 43374449

IUPAC2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide
SMILESCNC(=O)CN(C)CC(O)Cn1cc(N)cn1
InChIInChI=1S/C10H19N5O2/c1-12-10(17)7-14(2)5-9(16)6-15-4-8(11)3-13-15/h3-4,9,16H,5-7,11H2,1-2H3,(H,12,17)
InChIKeyLZIAOMRKHZXXKA-UHFFFAOYSA-N
MW241.29 g/mol
LogP-1.50
Rot. Bonds6

About 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide

2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide (PubChem CID 43374449) has the molecular formula C10H19N5O2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide
PubChem CID43374449
Molecular FormulaC10H19N5O2
Molecular Weight241.29 g/mol
Exact Mass241.15
IUPAC Name2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide
SMILESCNC(=O)CN(C)CC(O)Cn1cc(N)cn1
InChIInChI=1S/C10H19N5O2/c1-12-10(17)7-14(2)5-9(16)6-15-4-8(11)3-13-15/h3-4,9,16H,5-7,11H2,1-2H3,(H,12,17)
InChIKeyLZIAOMRKHZXXKA-UHFFFAOYSA-N
XLogP-1.50
TPSA96.41 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide
CID 43373776
2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-ethylamino]-N-methylacetamide
CID 43574922
1-(4-aminopyrazol-1-yl)-3-[methyl(2-phenylethyl)amino]propan-2-ol
CID 65483698
1-(4-aminopyrazol-1-yl)-3-[methyl(2-methylbutan-2-yl)amino]propan-2-ol
CID 63982844
1-(4-aminopyrazol-1-yl)-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]propan-2-ol
CID 63233045
1-(4-aminopyrazol-1-yl)-3-[3,3-dimethylbutan-2-yl(methyl)amino]propan-2-ol
CID 55007027
1-(4-aminopyrazol-1-yl)-3-[(2-chlorophenyl)methyl-methylamino]propan-2-ol
CID 61416751
ethyl (2R)-3-(4-aminopyrazol-1-yl)-2-hydroxypropanoate
CID 163467197
1-(4-aminopyrazol-1-yl)-3-[methyl(oxan-4-yl)amino]propan-2-ol
CID 43610733
3-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-ethylamino]-2-methylpropanenitrile
CID 54988819
4-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylmorpholine-3-carboxamide
CID 83106929
1-(4-aminopyrazol-1-yl)-3-methylbutan-2-ol
CID 83529434

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide?
The IUPAC name of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide (CID 43374449) is 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide.
What is the SMILES notation for 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide?
The canonical SMILES for 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide is CNC(=O)CN(C)CC(O)Cn1cc(N)cn1.
What is the InChIKey of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide?
The InChIKey is LZIAOMRKHZXXKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2/c1-12-10(17)7-14(2)5-9(16)6-15-4-8(11)3-13-15/h3-4,9,16H,5-7,11H2,1-2H3,(H,12,17).
What are the key properties of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide?
2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide has a molecular weight of 241.29 g/mol, XLogP of -1.50, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]-N-methylacetamide is sourced from PubChem (CID 43374449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).