2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide

C13H14ClN3O2S — CID 106033376

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide
SMILESNc1ccc(=O)n(CC(=O)NCCc2ccc(Cl)s2)c1
InChIInChI=1S/C13H14ClN3O2S/c14-11-3-2-10(20-11)5-6-16-12(18)8-17-7-9(15)1-4-13(17)19/h1-4,7H,5-6,8,15H2,(H,16,18)
InChIKeyMNYRPFIXAKMVNC-UHFFFAOYSA-N
MW311.79 g/mol
LogP1.50
Rot. Bonds5

About 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide (PubChem CID 106033376) has the molecular formula C13H14ClN3O2S and a molecular weight of 311.79 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide
PubChem CID106033376
Molecular FormulaC13H14ClN3O2S
Molecular Weight311.79 g/mol
Exact Mass311.05
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide
SMILESNc1ccc(=O)n(CC(=O)NCCc2ccc(Cl)s2)c1
InChIInChI=1S/C13H14ClN3O2S/c14-11-3-2-10(20-11)5-6-16-12(18)8-17-7-9(15)1-4-13(17)19/h1-4,7H,5-6,8,15H2,(H,16,18)
InChIKeyMNYRPFIXAKMVNC-UHFFFAOYSA-N
XLogP1.50
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.79
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide
CID 114138951
2-(5-amino-2-oxo-1-pyridinyl)-N-[(5-bromothiophen-2-yl)methyl]acetamide
CID 62815486
2-(3-amino-1,2,4-triazol-1-yl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide
CID 106033257
2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(cyclopenten-1-yl)ethyl]acetamide
CID 106163896
2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride
CID 119296190
2-(5-amino-2-oxo-1-pyridinyl)-N-[3-(dimethylamino)propyl]acetamide
CID 62815634
N-[2-(5-chlorothiophen-2-yl)ethyl]-2-piperazin-1-ylacetamide
CID 106047885
N-[2-(4-aminophenyl)ethyl]-3-(5-chlorothiophen-2-yl)propanamide
CID 119548205
2-(5-amino-2-oxo-1-pyridinyl)-N-[4-(dimethylamino)butyl]acetamide
CID 55118154
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-cyclopentylethyl)acetamide
CID 55118486
3-[2-(5-chlorothiophen-2-yl)ethylamino]-3-oxopropanoic acid
CID 104889314
2-(5-chlorothiophen-2-yl)ethylcarbamic acid
CID 115171101

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide (CID 106033376) is 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide is Nc1ccc(=O)n(CC(=O)NCCc2ccc(Cl)s2)c1.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide?
The InChIKey is MNYRPFIXAKMVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O2S/c14-11-3-2-10(20-11)5-6-16-12(18)8-17-7-9(15)1-4-13(17)19/h1-4,7H,5-6,8,15H2,(H,16,18).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide has a molecular weight of 311.79 g/mol, XLogP of 1.50, 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-(5-chlorothiophen-2-yl)ethyl]acetamide is sourced from PubChem (CID 106033376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).