5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide

C24H24N4O2S — CID 102189253

IUPAC5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide
SMILESCN(C)c1cccc2c(S(=O)(=O)N(Cc3ccccn3)Cc3ccccn3)cccc12
InChIInChI=1S/C24H24N4O2S/c1-27(2)23-13-7-12-22-21(23)11-8-14-24(22)31(29,30)28(17-19-9-3-5-15-25-19)18-20-10-4-6-16-26-20/h3-16H,17-18H2,1-2H3
InChIKeyHQRCVBLUPMYSCU-UHFFFAOYSA-N
MW432.55 g/mol
LogP4.09
Rot. Bonds7

About 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide

5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide (PubChem CID 102189253) has the molecular formula C24H24N4O2S and a molecular weight of 432.55 g/mol. Its IUPAC name is 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide.

Molecular Properties

Compound Name5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide
PubChem CID102189253
Molecular FormulaC24H24N4O2S
Molecular Weight432.55 g/mol
Exact Mass432.16
IUPAC Name5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide
SMILESCN(C)c1cccc2c(S(=O)(=O)N(Cc3ccccn3)Cc3ccccn3)cccc12
InChIInChI=1S/C24H24N4O2S/c1-27(2)23-13-7-12-22-21(23)11-8-14-24(22)31(29,30)28(17-19-9-3-5-15-25-19)18-20-10-4-6-16-26-20/h3-16H,17-18H2,1-2H3
InChIKeyHQRCVBLUPMYSCU-UHFFFAOYSA-N
XLogP4.09
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.55
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-bis(1,3-benzothiazol-2-ylmethyl)-5-(dimethylamino)naphthalene-1-sulfonamide
CID 177476330
CID 101257562
CID 101257562
3,5-dimethyl-N,N-bis(pyridin-2-ylmethyl)benzenesulfonamide
CID 102189251
2,4,6-trimethyl-N,N-bis(pyridin-2-ylmethyl)benzenesulfonamide
CID 102189250
5-(dimethylamino)-N-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonyl-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonyl-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonyl-ethylamino]propyl]amino](214C)propyl]amino]propyl]-N-ethylnaphthalene-1-sulfonamide
CID 10820158
N,N-bis(3-azidopropyl)-5-(dimethylamino)naphthalene-1-sulfonamide
CID 71405546
2-[5-(dimethylamino)naphthalen-1-yl]sulfonylacetonitrile
CID 175383513
3-[5-(dimethylamino)naphthalen-1-yl]sulfonyliminopentanedioic acid
CID 10571679
2-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 121084730
5-(dimethylamino)-N,N-bis[4-[4-(ethylamino)butylamino]butyl]naphthalene-1-sulfonamide
CID 102092589
2-chloro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 121084747
5-(dimethylamino)-N-[(4-methylphenyl)methyl]-N-pyridin-3-ylnaphthalene-1-sulfonamide
CID 173439861

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide?
The IUPAC name of 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide (CID 102189253) is 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide.
What is the SMILES notation for 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide?
The canonical SMILES for 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide is CN(C)c1cccc2c(S(=O)(=O)N(Cc3ccccn3)Cc3ccccn3)cccc12.
What is the InChIKey of 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide?
The InChIKey is HQRCVBLUPMYSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O2S/c1-27(2)23-13-7-12-22-21(23)11-8-14-24(22)31(29,30)28(17-19-9-3-5-15-25-19)18-20-10-4-6-16-26-20/h3-16H,17-18H2,1-2H3.
What are the key properties of 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide?
5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide has a molecular weight of 432.55 g/mol, XLogP of 4.09, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-N,N-bis(pyridin-2-ylmethyl)naphthalene-1-sulfonamide is sourced from PubChem (CID 102189253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).