N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide

C12H17N3O3S — CID 114598969

IUPACN-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
SMILESCS(=O)(=O)c1cccnc1NCCC(=O)NC1CC1
InChIInChI=1S/C12H17N3O3S/c1-19(17,18)10-3-2-7-13-12(10)14-8-6-11(16)15-9-4-5-9/h2-3,7,9H,4-6,8H2,1H3,(H,13,14)(H,15,16)
InChIKeyFBIHTGRDUMFBKU-UHFFFAOYSA-N
MW283.35 g/mol
LogP0.57
Rot. Bonds6

About N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide

N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide (PubChem CID 114598969) has the molecular formula C12H17N3O3S and a molecular weight of 283.35 g/mol. Its IUPAC name is N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
PubChem CID114598969
Molecular FormulaC12H17N3O3S
Molecular Weight283.35 g/mol
Exact Mass283.10
IUPAC NameN-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
SMILESCS(=O)(=O)c1cccnc1NCCC(=O)NC1CC1
InChIInChI=1S/C12H17N3O3S/c1-19(17,18)10-3-2-7-13-12(10)14-8-6-11(16)15-9-4-5-9/h2-3,7,9H,4-6,8H2,1H3,(H,13,14)(H,15,16)
InChIKeyFBIHTGRDUMFBKU-UHFFFAOYSA-N
XLogP0.57
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]butanamide
CID 114598970
3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide
CID 113220281
4-[(3-chloro-2-pyridinyl)amino]-N-cyclopropylbutanamide
CID 79401819
N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide
CID 80922661
N-cyclopropyl-2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]acetamide
CID 62146294
N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide
CID 135089182
N-cyclopropyl-3-[(5-methoxyisoquinolin-1-yl)amino]propanamide
CID 106539065
3-[(3-cyanopyrazin-2-yl)amino]-N-cyclopropylpropanamide
CID 79393897
N'-(3-methylsulfonyl-2-pyridinyl)-N-propylethane-1,2-diamine
CID 114599239
3-[(2-chloro-6-methylsulfonylphenyl)methylamino]-N-cyclopropylpropanamide
CID 83167961
2-[(3-methylsulfonyl-2-pyridinyl)amino]-N-propan-2-ylacetamide
CID 114598664
3-methylsulfonyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine
CID 114598848

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide (CID 114598969) is N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide is CS(=O)(=O)c1cccnc1NCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide?
The InChIKey is FBIHTGRDUMFBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3S/c1-19(17,18)10-3-2-7-13-12(10)14-8-6-11(16)15-9-4-5-9/h2-3,7,9H,4-6,8H2,1H3,(H,13,14)(H,15,16).
What are the key properties of N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide?
N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide has a molecular weight of 283.35 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide is sourced from PubChem (CID 114598969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).