N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide

C14H23N3O2S — CID 63995589

IUPACN-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide
SMILESCCCNc1cc(S(=O)(=O)NC(C)CC2CC2)ccn1
InChIInChI=1S/C14H23N3O2S/c1-3-7-15-14-10-13(6-8-16-14)20(18,19)17-11(2)9-12-4-5-12/h6,8,10-12,17H,3-5,7,9H2,1-2H3,(H,15,16)
InChIKeyREZJARIMWFVTAZ-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.37
Rot. Bonds8

About N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide

N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide (PubChem CID 63995589) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide
PubChem CID63995589
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide
SMILESCCCNc1cc(S(=O)(=O)NC(C)CC2CC2)ccn1
InChIInChI=1S/C14H23N3O2S/c1-3-7-15-14-10-13(6-8-16-14)20(18,19)17-11(2)9-12-4-5-12/h6,8,10-12,17H,3-5,7,9H2,1-2H3,(H,15,16)
InChIKeyREZJARIMWFVTAZ-UHFFFAOYSA-N
XLogP2.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyclopropylpropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 63996785
N-(dicyclopropylmethyl)-2-(propylamino)pyridine-4-sulfonamide
CID 62152445
N-(4-hydroxycyclohexyl)-2-(propylamino)pyridine-4-sulfonamide
CID 62150249
2-(propylamino)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-sulfonamide
CID 106283483
N-[(1-methylpyrrolidin-3-yl)methyl]-2-(propylamino)pyridine-4-sulfonamide
CID 62146336
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
2-(propylamino)-N-(pyridin-4-ylmethyl)pyridine-4-sulfonamide
CID 62148405
N-(1-ethoxypropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62158252
[1-[[2-(propylamino)-4-pyridinyl]sulfonyl]piperidin-4-yl]methanol
CID 62164530
N-(2-oxopiperidin-3-yl)-2-(propylamino)pyridine-4-sulfonamide
CID 62146358
N-(1-cyclopropylpropan-2-yl)-4-(ethylamino)benzenesulfonamide
CID 63996191
2-(methylamino)-N-(4-methylpentan-2-yl)pyridine-4-sulfonamide
CID 55044390

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide (CID 63995589) is N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide is CCCNc1cc(S(=O)(=O)NC(C)CC2CC2)ccn1.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide?
The InChIKey is REZJARIMWFVTAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-7-15-14-10-13(6-8-16-14)20(18,19)17-11(2)9-12-4-5-12/h6,8,10-12,17H,3-5,7,9H2,1-2H3,(H,15,16).
What are the key properties of N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide?
N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.37, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-2-(propylamino)pyridine-4-sulfonamide is sourced from PubChem (CID 63995589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).