N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide

C14H24N2O3S — CID 829835

IUPACN,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide
SMILESCC(C)Oc1ccc(S(=O)(=O)N(C(C)C)C(C)C)cn1
InChIInChI=1S/C14H24N2O3S/c1-10(2)16(11(3)4)20(17,18)13-7-8-14(15-9-13)19-12(5)6/h7-12H,1-6H3
InChIKeyFWYRKRMKUSQLLB-UHFFFAOYSA-N
MW300.42 g/mol
LogP2.68
Rot. Bonds6

About N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide

N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide (PubChem CID 829835) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide.

Molecular Properties

Compound NameN,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide
PubChem CID829835
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC NameN,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide
SMILESCC(C)Oc1ccc(S(=O)(=O)N(C(C)C)C(C)C)cn1
InChIInChI=1S/C14H24N2O3S/c1-10(2)16(11(3)4)20(17,18)13-7-8-14(15-9-13)19-12(5)6/h7-12H,1-6H3
InChIKeyFWYRKRMKUSQLLB-UHFFFAOYSA-N
XLogP2.68
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide?
The IUPAC name of N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide (CID 829835) is N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide.
What is the SMILES notation for N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide?
The canonical SMILES for N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide is CC(C)Oc1ccc(S(=O)(=O)N(C(C)C)C(C)C)cn1.
What is the InChIKey of N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide?
The InChIKey is FWYRKRMKUSQLLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S/c1-10(2)16(11(3)4)20(17,18)13-7-8-14(15-9-13)19-12(5)6/h7-12H,1-6H3.
What are the key properties of N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide?
N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide has a molecular weight of 300.42 g/mol, XLogP of 2.68, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)-6-propan-2-yloxypyridine-3-sulfonamide is sourced from PubChem (CID 829835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).