2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide

C13H18N4O3 — CID 62815825

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
SMILESCN(CC(=O)NC1CC1)C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C13H18N4O3/c1-16(7-11(18)15-10-3-4-10)13(20)8-17-6-9(14)2-5-12(17)19/h2,5-6,10H,3-4,7-8,14H2,1H3,(H,15,18)
InChIKeyNNYWRORZENOZIE-UHFFFAOYSA-N
MW278.31 g/mol
LogP-0.83
Rot. Bonds5

About 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide (PubChem CID 62815825) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
PubChem CID62815825
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
SMILESCN(CC(=O)NC1CC1)C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C13H18N4O3/c1-16(7-11(18)15-10-3-4-10)13(20)8-17-6-9(14)2-5-12(17)19/h2,5-6,10H,3-4,7-8,14H2,1H3,(H,15,18)
InChIKeyNNYWRORZENOZIE-UHFFFAOYSA-N
XLogP-0.83
TPSA97.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide (CID 62815825) is 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide is CN(CC(=O)NC1CC1)C(=O)Cn1cc(N)ccc1=O.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
The InChIKey is NNYWRORZENOZIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O3/c1-16(7-11(18)15-10-3-4-10)13(20)8-17-6-9(14)2-5-12(17)19/h2,5-6,10H,3-4,7-8,14H2,1H3,(H,15,18).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide has a molecular weight of 278.31 g/mol, XLogP of -0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide is sourced from PubChem (CID 62815825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).