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

C9H17N5O2 — CID 43373776

IUPAC2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide
SMILESCN(CC(N)=O)CC(O)Cn1cc(N)cn1
InChIInChI=1S/C9H17N5O2/c1-13(6-9(11)16)4-8(15)5-14-3-7(10)2-12-14/h2-3,8,15H,4-6,10H2,1H3,(H2,11,16)
InChIKeyBBILDZJCUPVDLW-UHFFFAOYSA-N
MW227.27 g/mol
LogP-1.76
Rot. Bonds6

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

2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide (PubChem CID 43373776) has the molecular formula C9H17N5O2 and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide.

Molecular Properties

Compound Name2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide
PubChem CID43373776
Molecular FormulaC9H17N5O2
Molecular Weight227.27 g/mol
Exact Mass227.14
IUPAC Name2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide
SMILESCN(CC(N)=O)CC(O)Cn1cc(N)cn1
InChIInChI=1S/C9H17N5O2/c1-13(6-9(11)16)4-8(15)5-14-3-7(10)2-12-14/h2-3,8,15H,4-6,10H2,1H3,(H2,11,16)
InChIKeyBBILDZJCUPVDLW-UHFFFAOYSA-N
XLogP-1.76
TPSA110.40 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 5-1.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide?
The IUPAC name of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide (CID 43373776) is 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide.
What is the SMILES notation for 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide?
The canonical SMILES for 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide is CN(CC(N)=O)CC(O)Cn1cc(N)cn1.
What is the InChIKey of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide?
The InChIKey is BBILDZJCUPVDLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O2/c1-13(6-9(11)16)4-8(15)5-14-3-7(10)2-12-14/h2-3,8,15H,4-6,10H2,1H3,(H2,11,16).
What are the key properties of 2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide?
2-[[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-methylamino]acetamide has a molecular weight of 227.27 g/mol, XLogP of -1.76, 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]acetamide is sourced from PubChem (CID 43373776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).