N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide

C11H15N3O2 — CID 47412168

IUPACN-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide
SMILESCCC(=O)NCC(=O)NCc1ccccn1
InChIInChI=1S/C11H15N3O2/c1-2-10(15)14-8-11(16)13-7-9-5-3-4-6-12-9/h3-6H,2,7-8H2,1H3,(H,13,16)(H,14,15)
InChIKeyVMXHNLIJZRBOQU-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.22
Rot. Bonds5

About N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide

N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide (PubChem CID 47412168) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide
PubChem CID47412168
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide
SMILESCCC(=O)NCC(=O)NCc1ccccn1
InChIInChI=1S/C11H15N3O2/c1-2-10(15)14-8-11(16)13-7-9-5-3-4-6-12-9/h3-6H,2,7-8H2,1H3,(H,13,16)(H,14,15)
InChIKeyVMXHNLIJZRBOQU-UHFFFAOYSA-N
XLogP0.22
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]benzamide
CID 9414555
2-(2-ethylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999248
2-ethylsulfanyl-N-(pyridin-2-ylmethyl)acetamide
CID 19005858
5-methyl-N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]thiophene-2-carboxamide
CID 18107585
2-(4-acetamidoanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999289
2-fluoro-N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]benzamide
CID 4781382
2-(2-tert-butylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999257
2-[(2-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 112993044
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 112993027
2-(2-ethyl-6-methylanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 108999251
3-iodo-N-(pyridin-2-ylmethyl)propanamide
CID 163408162
4-hydroxy-N-(pyridin-2-ylmethyl)pentanamide
CID 79016708

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide?
The IUPAC name of N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide (CID 47412168) is N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide.
What is the SMILES notation for N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide?
The canonical SMILES for N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide is CCC(=O)NCC(=O)NCc1ccccn1.
What is the InChIKey of N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide?
The InChIKey is VMXHNLIJZRBOQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-2-10(15)14-8-11(16)13-7-9-5-3-4-6-12-9/h3-6H,2,7-8H2,1H3,(H,13,16)(H,14,15).
What are the key properties of N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide?
N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide has a molecular weight of 221.26 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide is sourced from PubChem (CID 47412168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).