N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide

C14H26N4O2S — CID 62159357

IUPACN-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)NC(CN(C)C)C(C)C)cn1
InChIInChI=1S/C14H26N4O2S/c1-6-15-14-8-7-12(9-16-14)21(19,20)17-13(11(2)3)10-18(4)5/h7-9,11,13,17H,6,10H2,1-5H3,(H,15,16)
InChIKeyOLVUGPAQJRSHAJ-UHFFFAOYSA-N
MW314.46 g/mol
LogP1.38
Rot. Bonds8

About N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide

N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide (PubChem CID 62159357) has the molecular formula C14H26N4O2S and a molecular weight of 314.46 g/mol. Its IUPAC name is N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide
PubChem CID62159357
Molecular FormulaC14H26N4O2S
Molecular Weight314.46 g/mol
Exact Mass314.18
IUPAC NameN-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)NC(CN(C)C)C(C)C)cn1
InChIInChI=1S/C14H26N4O2S/c1-6-15-14-8-7-12(9-16-14)21(19,20)17-13(11(2)3)10-18(4)5/h7-9,11,13,17H,6,10H2,1-5H3,(H,15,16)
InChIKeyOLVUGPAQJRSHAJ-UHFFFAOYSA-N
XLogP1.38
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.46
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(aminomethyl)-N-[1-(dimethylamino)-3-methylbutan-2-yl]pyridine-3-sulfonamide
CID 114613286
2-[[6-(ethylamino)-3-pyridinyl]sulfonylamino]propanamide
CID 62147681
6-(ethylamino)-N-methylpyridine-3-sulfonamide
CID 62150384
6-(ethylamino)-N-(2-hydroxypropyl)-N-methylpyridine-3-sulfonamide
CID 62337809
6-(ethylamino)-N-methyl-N-(3-methylbutyl)pyridine-3-sulfonamide
CID 62151361
N-(3-methylbutan-2-yl)-6-(propylamino)pyridine-3-sulfonamide
CID 62143390
N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-hydrazinylbenzenesulfonamide
CID 61478066
6-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]pyridine-3-sulfonamide
CID 62640395
N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61479202
N-(2,2-dimethylbutyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 103464350
2-amino-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-methylbenzenesulfonamide
CID 61476316
6-(ethylamino)-N-(2-methoxyethyl)pyridine-3-sulfonamide
CID 62148459

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide?
The IUPAC name of N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide (CID 62159357) is N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)NC(CN(C)C)C(C)C)cn1.
What is the InChIKey of N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide?
The InChIKey is OLVUGPAQJRSHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2S/c1-6-15-14-8-7-12(9-16-14)21(19,20)17-13(11(2)3)10-18(4)5/h7-9,11,13,17H,6,10H2,1-5H3,(H,15,16).
What are the key properties of N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide?
N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide has a molecular weight of 314.46 g/mol, XLogP of 1.38, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-(ethylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62159357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).