5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide

C10H15N5O2 — CID 103101079

IUPAC5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide
SMILESCCN(CC(N)=O)c1ncc(N)cc1C(N)=O
InChIInChI=1S/C10H15N5O2/c1-2-15(5-8(12)16)10-7(9(13)17)3-6(11)4-14-10/h3-4H,2,5,11H2,1H3,(H2,12,16)(H2,13,17)
InChIKeyQFIBBLNAONARAB-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.93
Rot. Bonds5

About 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide

5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide (PubChem CID 103101079) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide
PubChem CID103101079
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC Name5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide
SMILESCCN(CC(N)=O)c1ncc(N)cc1C(N)=O
InChIInChI=1S/C10H15N5O2/c1-2-15(5-8(12)16)10-7(9(13)17)3-6(11)4-14-10/h3-4H,2,5,11H2,1H3,(H2,12,16)(H2,13,17)
InChIKeyQFIBBLNAONARAB-UHFFFAOYSA-N
XLogP-0.93
TPSA128.33 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide (CID 103101079) is 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide is CCN(CC(N)=O)c1ncc(N)cc1C(N)=O.
What is the InChIKey of 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide?
The InChIKey is QFIBBLNAONARAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2/c1-2-15(5-8(12)16)10-7(9(13)17)3-6(11)4-14-10/h3-4H,2,5,11H2,1H3,(H2,12,16)(H2,13,17).
What are the key properties of 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide?
5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.93, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 103101079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).