2-[2-(propylamino)phenyl]sulfanylacetamide

C11H16N2OS — CID 43722615

IUPAC2-[2-(propylamino)phenyl]sulfanylacetamide
SMILESCCCNc1ccccc1SCC(N)=O
InChIInChI=1S/C11H16N2OS/c1-2-7-13-9-5-3-4-6-10(9)15-8-11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14)
InChIKeyUVXCBILBUFXTFR-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.09
Rot. Bonds6

About 2-[2-(propylamino)phenyl]sulfanylacetamide

2-[2-(propylamino)phenyl]sulfanylacetamide (PubChem CID 43722615) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-[2-(propylamino)phenyl]sulfanylacetamide.

Molecular Properties

Compound Name2-[2-(propylamino)phenyl]sulfanylacetamide
PubChem CID43722615
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name2-[2-(propylamino)phenyl]sulfanylacetamide
SMILESCCCNc1ccccc1SCC(N)=O
InChIInChI=1S/C11H16N2OS/c1-2-7-13-9-5-3-4-6-10(9)15-8-11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14)
InChIKeyUVXCBILBUFXTFR-UHFFFAOYSA-N
XLogP2.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(cyclopropylmethylamino)phenyl]sulfanylacetamide
CID 43722610
2-[2-[[2-(aminomethyl)-3-methylbutyl]amino]phenyl]sulfanylacetamide
CID 107441649
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]hexanamide
CID 46421409
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-(ethylamino)-2-methylpropanamide
CID 62832519
2-[2-[2-(2-fluorophenoxy)ethylamino]phenyl]sulfanylacetamide
CID 51248663
2-[2-[(3-propylimidazol-4-yl)methylamino]phenyl]sulfanylacetamide
CID 66130148
2-[2-(propylamino)phenyl]acetamide
CID 43738591
2-[2-[(3-chloro-4-methylphenyl)methylamino]phenyl]sulfanylacetamide
CID 106816431
2-[2-[(2-methoxyphenyl)methylamino]phenyl]sulfanylacetamide
CID 43231952
2-[2-[(2-bromoacetyl)amino]phenyl]sulfanylacetamide
CID 63681205
2-[2-(5-methylheptan-3-ylamino)phenyl]sulfanylacetamide
CID 43722576
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-4-(methylamino)butanamide
CID 54925110

Frequently Asked Questions

What is the IUPAC name of 2-[2-(propylamino)phenyl]sulfanylacetamide?
The IUPAC name of 2-[2-(propylamino)phenyl]sulfanylacetamide (CID 43722615) is 2-[2-(propylamino)phenyl]sulfanylacetamide.
What is the SMILES notation for 2-[2-(propylamino)phenyl]sulfanylacetamide?
The canonical SMILES for 2-[2-(propylamino)phenyl]sulfanylacetamide is CCCNc1ccccc1SCC(N)=O.
What is the InChIKey of 2-[2-(propylamino)phenyl]sulfanylacetamide?
The InChIKey is UVXCBILBUFXTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-2-7-13-9-5-3-4-6-10(9)15-8-11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14).
What are the key properties of 2-[2-(propylamino)phenyl]sulfanylacetamide?
2-[2-(propylamino)phenyl]sulfanylacetamide has a molecular weight of 224.33 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(propylamino)phenyl]sulfanylacetamide is sourced from PubChem (CID 43722615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).