3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine

C15H25N3O2S — CID 62150305

IUPAC3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
SMILESCCCNc1ncccc1S(=O)(=O)N1CCCCCCC1
InChIInChI=1S/C15H25N3O2S/c1-2-10-16-15-14(9-8-11-17-15)21(19,20)18-12-6-4-3-5-7-13-18/h8-9,11H,2-7,10,12-13H2,1H3,(H,16,17)
InChIKeyBKSHNAZFNXGOGQ-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.86
Rot. Bonds5

About 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine

3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine (PubChem CID 62150305) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
PubChem CID62150305
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
SMILESCCCNc1ncccc1S(=O)(=O)N1CCCCCCC1
InChIInChI=1S/C15H25N3O2S/c1-2-10-16-15-14(9-8-11-17-15)21(19,20)18-12-6-4-3-5-7-13-18/h8-9,11H,2-7,10,12-13H2,1H3,(H,16,17)
InChIKeyBKSHNAZFNXGOGQ-UHFFFAOYSA-N
XLogP2.86
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine 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

3-(1,4-oxazepan-4-ylsulfonyl)-N-propylpyridin-2-amine
CID 62966790
2-[(3-piperidin-1-ylsulfonyl-2-pyridinyl)amino]-N-propylacetamide
CID 133383079
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylsulfonyl)-N-propylpyridin-2-amine
CID 115561614
N-(2-cycloheptyloxyethyl)-3-piperidin-1-ylsulfonylpyridin-2-amine
CID 133308692
3-(2-methylmorpholin-4-yl)sulfonyl-N-propylpyridin-2-amine
CID 62149023
3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]sulfonyl-N-propylpyridin-2-amine
CID 104968712
N'-(3-piperidin-1-ylsulfonyl-2-pyridinyl)-N-quinolin-2-ylethane-1,2-diamine
CID 133309762
N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 55043901
N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148584
N-[2-(3,6-dihydro-2H-pyran-4-yl)ethyl]-3-piperidin-1-ylsulfonylpyridin-2-amine
CID 133390540
N-[(4-methylmorpholin-2-yl)methyl]-3-piperidin-1-ylsulfonylpyridin-2-amine
CID 127297981
N-(3-chloro-2-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 103094788

Frequently Asked Questions

What is the IUPAC name of 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine?
The IUPAC name of 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine (CID 62150305) is 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine.
What is the SMILES notation for 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine?
The canonical SMILES for 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine is CCCNc1ncccc1S(=O)(=O)N1CCCCCCC1.
What is the InChIKey of 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine?
The InChIKey is BKSHNAZFNXGOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-2-10-16-15-14(9-8-11-17-15)21(19,20)18-12-6-4-3-5-7-13-18/h8-9,11H,2-7,10,12-13H2,1H3,(H,16,17).
What are the key properties of 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine?
3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine has a molecular weight of 311.45 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine is sourced from PubChem (CID 62150305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).