2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide

C11H14N4O2S — CID 43301222

IUPAC2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide
SMILESNc1ccc(SCC(=O)NC(=O)NC2CC2)nc1
InChIInChI=1S/C11H14N4O2S/c12-7-1-4-10(13-5-7)18-6-9(16)15-11(17)14-8-2-3-8/h1,4-5,8H,2-3,6,12H2,(H2,14,15,16,17)
InChIKeyULRKYUNSVMESSI-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.74
Rot. Bonds4

About 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide

2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide (PubChem CID 43301222) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide
PubChem CID43301222
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide
SMILESNc1ccc(SCC(=O)NC(=O)NC2CC2)nc1
InChIInChI=1S/C11H14N4O2S/c12-7-1-4-10(13-5-7)18-6-9(16)15-11(17)14-8-2-3-8/h1,4-5,8H,2-3,6,12H2,(H2,14,15,16,17)
InChIKeyULRKYUNSVMESSI-UHFFFAOYSA-N
XLogP0.74
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminophenyl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide
CID 43299295
2-[(5-amino-2-pyridinyl)sulfanyl]-N-(2-methylcyclohexyl)acetamide
CID 43301392
N-(cyclopentylcarbamoyl)-2-[(5-piperidin-1-ylsulfonyl-2-pyridinyl)sulfanyl]acetamide
CID 30117534
2-[(3-amino-4-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide
CID 43299826
2-(2-aminophenyl)sulfanyl-N-(cyclopropylcarbamoyl)acetamide
CID 43249110
2-[(5-amino-2-pyridinyl)sulfanyl]-N-(2-methylbutan-2-yl)acetamide
CID 43301260
N-cyclopropyl-2-[[5-(1-hydroxyethyl)-2-pyridinyl]sulfanyl]acetamide
CID 114234869
2-(4-aminophenoxy)-N-(cyclopropylcarbamoyl)acetamide
CID 54908932
2-[(5-amino-2-pyridinyl)sulfanyl]-N-(1-cyano-1-cyclopropylethyl)acetamide
CID 43301359
2-(2-amino-4-chlorophenyl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide
CID 43250989
N-(cyclohexylcarbamoyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide
CID 7415704
2-(4-aminophenyl)sulfanyl-N-cyclopentylacetamide
CID 19317767

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide?
The IUPAC name of 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide (CID 43301222) is 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide.
What is the SMILES notation for 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide?
The canonical SMILES for 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide is Nc1ccc(SCC(=O)NC(=O)NC2CC2)nc1.
What is the InChIKey of 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide?
The InChIKey is ULRKYUNSVMESSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c12-7-1-4-10(13-5-7)18-6-9(16)15-11(17)14-8-2-3-8/h1,4-5,8H,2-3,6,12H2,(H2,14,15,16,17).
What are the key properties of 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide?
2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide has a molecular weight of 266.33 g/mol, XLogP of 0.74, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-2-pyridinyl)sulfanyl]-N-(cyclopropylcarbamoyl)acetamide is sourced from PubChem (CID 43301222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).