2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide

C10H16N4O — CID 103101253

IUPAC2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1ccc(CN)cn1
InChIInChI=1S/C10H16N4O/c1-2-14(7-9(12)15)10-4-3-8(5-11)6-13-10/h3-4,6H,2,5,7,11H2,1H3,(H2,12,15)
InChIKeyOQPDHLHGXIDFPW-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.15
Rot. Bonds5

About 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide

2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide (PubChem CID 103101253) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide.

Molecular Properties

Compound Name2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide
PubChem CID103101253
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1ccc(CN)cn1
InChIInChI=1S/C10H16N4O/c1-2-14(7-9(12)15)10-4-3-8(5-11)6-13-10/h3-4,6H,2,5,7,11H2,1H3,(H2,12,15)
InChIKeyOQPDHLHGXIDFPW-UHFFFAOYSA-N
XLogP-0.15
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide?
The IUPAC name of 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide (CID 103101253) is 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide.
What is the SMILES notation for 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide?
The canonical SMILES for 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide is CCN(CC(N)=O)c1ccc(CN)cn1.
What is the InChIKey of 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide?
The InChIKey is OQPDHLHGXIDFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-2-14(7-9(12)15)10-4-3-8(5-11)6-13-10/h3-4,6H,2,5,7,11H2,1H3,(H2,12,15).
What are the key properties of 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide?
2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide has a molecular weight of 208.26 g/mol, XLogP of -0.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(aminomethyl)-2-pyridinyl]-ethylamino]acetamide is sourced from PubChem (CID 103101253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).