4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide

C10H14N4O2 — CID 43517858

IUPAC4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC(N)=O)ccn1
InChIInChI=1S/C10H14N4O2/c1-2-12-10(16)8-5-7(3-4-13-8)14-6-9(11)15/h3-5H,2,6H2,1H3,(H2,11,15)(H,12,16)(H,13,14)
InChIKeyWFZZIHUCQCJMPY-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.27
Rot. Bonds5

About 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide

4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide (PubChem CID 43517858) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
PubChem CID43517858
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC(N)=O)ccn1
InChIInChI=1S/C10H14N4O2/c1-2-12-10(16)8-5-7(3-4-13-8)14-6-9(11)15/h3-5H,2,6H2,1H3,(H2,11,15)(H,12,16)(H,13,14)
InChIKeyWFZZIHUCQCJMPY-UHFFFAOYSA-N
XLogP-0.27
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide (CID 43517858) is 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(NCC(N)=O)ccn1.
What is the InChIKey of 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide?
The InChIKey is WFZZIHUCQCJMPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-2-12-10(16)8-5-7(3-4-13-8)14-6-9(11)15/h3-5H,2,6H2,1H3,(H2,11,15)(H,12,16)(H,13,14).
What are the key properties of 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide?
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.27, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 43517858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).