2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide

C9H13N5O2 — CID 104540322

IUPAC2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide
SMILESNC(=O)CN(CC(N)=O)c1cccnc1N
InChIInChI=1S/C9H13N5O2/c10-7(15)4-14(5-8(11)16)6-2-1-3-13-9(6)12/h1-3H,4-5H2,(H2,10,15)(H2,11,16)(H2,12,13)
InChIKeyBSIRLTYPXLKAMQ-UHFFFAOYSA-N
MW223.24 g/mol
LogP-1.56
Rot. Bonds5

About 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide

2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide (PubChem CID 104540322) has the molecular formula C9H13N5O2 and a molecular weight of 223.24 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide
PubChem CID104540322
Molecular FormulaC9H13N5O2
Molecular Weight223.24 g/mol
Exact Mass223.11
IUPAC Name2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide
SMILESNC(=O)CN(CC(N)=O)c1cccnc1N
InChIInChI=1S/C9H13N5O2/c10-7(15)4-14(5-8(11)16)6-2-1-3-13-9(6)12/h1-3H,4-5H2,(H2,10,15)(H2,11,16)(H2,12,13)
InChIKeyBSIRLTYPXLKAMQ-UHFFFAOYSA-N
XLogP-1.56
TPSA128.33 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 5-1.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]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-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide (CID 104540322) is 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide is NC(=O)CN(CC(N)=O)c1cccnc1N.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide?
The InChIKey is BSIRLTYPXLKAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5O2/c10-7(15)4-14(5-8(11)16)6-2-1-3-13-9(6)12/h1-3H,4-5H2,(H2,10,15)(H2,11,16)(H2,12,13).
What are the key properties of 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide?
2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide has a molecular weight of 223.24 g/mol, XLogP of -1.56, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-(2-amino-3-pyridinyl)amino]acetamide is sourced from PubChem (CID 104540322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).