3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide

C15H25N3O2S — CID 103306540

IUPAC3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide
SMILESCC(C)CCN(C1CCCC1)S(=O)(=O)c1ncccc1N
InChIInChI=1S/C15H25N3O2S/c1-12(2)9-11-18(13-6-3-4-7-13)21(19,20)15-14(16)8-5-10-17-15/h5,8,10,12-13H,3-4,6-7,9,11,16H2,1-2H3
InChIKeyZXXOLHXAQPTSFM-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.64
Rot. Bonds6

About 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide

3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide (PubChem CID 103306540) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide
PubChem CID103306540
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide
SMILESCC(C)CCN(C1CCCC1)S(=O)(=O)c1ncccc1N
InChIInChI=1S/C15H25N3O2S/c1-12(2)9-11-18(13-6-3-4-7-13)21(19,20)15-14(16)8-5-10-17-15/h5,8,10,12-13H,3-4,6-7,9,11,16H2,1-2H3
InChIKeyZXXOLHXAQPTSFM-UHFFFAOYSA-N
XLogP2.64
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Methyl-N-pyridin-3-YL-benzenesulfonamide
CID 757406
4-fluoro-N-pyridin-3-ylbenzenesulfonamide
CID 676049
5-Aminopyridine-2-sulfonamide
CID 22313850
N-3-Pyridylbenzenesulfonamide
CID 339079
4-Ethyl-3,4-Dihydro-2h-Pyrido[3,2-E][1,2,4]thiadiazine 1,1-Dioxide
CID 10013456
4-Cyclopropyl-2,3-dihydropyrido[3,2-e][1,2,4]thiadiazine 1,1-dioxide
CID 118719353
n-(Pyridin-3-yl)pyridine-3-sulfonamide
CID 221243
4-Isobutyl-N-pyridin-3-yl-benzenesulfonamide
CID 778277
5-Methyl-2-pyridinesulfonamide
CID 3614199
3-Aminopyridine-2-sulfonamide
CID 14943702
6-(Methylsulfonyl)pyridin-3-amine
CID 20038977
N-(3-cyclopentylamino-4-pyridinyl)methanesulfonamide
CID 44473651

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide (CID 103306540) is 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide is CC(C)CCN(C1CCCC1)S(=O)(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide?
The InChIKey is ZXXOLHXAQPTSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-12(2)9-11-18(13-6-3-4-7-13)21(19,20)15-14(16)8-5-10-17-15/h5,8,10,12-13H,3-4,6-7,9,11,16H2,1-2H3.
What are the key properties of 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide?
3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide has a molecular weight of 311.45 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopentyl-N-(3-methylbutyl)pyridine-2-sulfonamide is sourced from PubChem (CID 103306540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).