2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide

C11H15N3OS — CID 63917691

IUPAC2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide
SMILESNC(=O)C(N)(CSc1ccccn1)C1CC1
InChIInChI=1S/C11H15N3OS/c12-10(15)11(13,8-4-5-8)7-16-9-3-1-2-6-14-9/h1-3,6,8H,4-5,7,13H2,(H2,12,15)
InChIKeyZUHADAOLJWAYSH-UHFFFAOYSA-N
MW237.33 g/mol
LogP0.77
Rot. Bonds5

About 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide

2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide (PubChem CID 63917691) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide
PubChem CID63917691
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide
SMILESNC(=O)C(N)(CSc1ccccn1)C1CC1
InChIInChI=1S/C11H15N3OS/c12-10(15)11(13,8-4-5-8)7-16-9-3-1-2-6-14-9/h1-3,6,8H,4-5,7,13H2,(H2,12,15)
InChIKeyZUHADAOLJWAYSH-UHFFFAOYSA-N
XLogP0.77
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanoic acid
CID 63917690
2-cyclopropyl-2-(methylamino)-3-pyridin-2-ylsulfanylpropanoic acid
CID 63917687
2-amino-3-(2-chlorophenyl)sulfanyl-2-cyclopropylpropanamide
CID 63917294
2-cyclopropyl-2-(cyclopropylamino)-3-pyridin-2-ylsulfanylpropanoic acid
CID 63917868
2-amino-2-cyclopropyl-3-(5-methylpyrimidin-2-yl)sulfanylpropanamide
CID 63918876
2-amino-2-cyclopropyl-3-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanamide
CID 63920649
2-amino-2-cyclopropyl-3-(4-methylphenyl)sulfanylpropanamide
CID 63917847
2-cyclopropyl-2-pyridin-2-ylsulfanylpropanoic acid
CID 82238766
2-(2,2-dimethylpropylsulfanyl)pyridine
CID 20674343
2-amino-2-cyclopropyl-3-(3-methoxyphenyl)sulfanylpropanamide
CID 63917104
2-(cyclopropylamino)-4-pyridin-2-ylsulfanylbutanamide
CID 63033420
N-carbamoyl-2-pyridin-2-ylsulfanylacetamide
CID 5147544

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide?
The IUPAC name of 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide (CID 63917691) is 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide is NC(=O)C(N)(CSc1ccccn1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide?
The InChIKey is ZUHADAOLJWAYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c12-10(15)11(13,8-4-5-8)7-16-9-3-1-2-6-14-9/h1-3,6,8H,4-5,7,13H2,(H2,12,15).
What are the key properties of 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide?
2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide has a molecular weight of 237.33 g/mol, XLogP of 0.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-pyridin-2-ylsulfanylpropanamide is sourced from PubChem (CID 63917691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).