N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide

C23H21N3O2S — CID 122283247

IUPACN-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1ccccc1-c1cn2c(n1)CCCC2)c1cccc2ccccc12
InChIInChI=1S/C23H21N3O2S/c27-29(28,22-13-7-9-17-8-1-2-10-18(17)22)25-20-12-4-3-11-19(20)21-16-26-15-6-5-14-23(26)24-21/h1-4,7-13,16,25H,5-6,14-15H2
InChIKeyMWRFWFFUNUXSPV-UHFFFAOYSA-N
MW403.51 g/mol
LogP4.84
Rot. Bonds4

About N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide

N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide (PubChem CID 122283247) has the molecular formula C23H21N3O2S and a molecular weight of 403.51 g/mol. Its IUPAC name is N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide
PubChem CID122283247
Molecular FormulaC23H21N3O2S
Molecular Weight403.51 g/mol
Exact Mass403.14
IUPAC NameN-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1ccccc1-c1cn2c(n1)CCCC2)c1cccc2ccccc12
InChIInChI=1S/C23H21N3O2S/c27-29(28,22-13-7-9-17-8-1-2-10-18(17)22)25-20-12-4-3-11-19(20)21-16-26-15-6-5-14-23(26)24-21/h1-4,7-13,16,25H,5-6,14-15H2
InChIKeyMWRFWFFUNUXSPV-UHFFFAOYSA-N
XLogP4.84
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.51
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide?
The IUPAC name of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide (CID 122283247) is N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide.
What is the SMILES notation for N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide?
The canonical SMILES for N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide is O=S(=O)(Nc1ccccc1-c1cn2c(n1)CCCC2)c1cccc2ccccc12.
What is the InChIKey of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide?
The InChIKey is MWRFWFFUNUXSPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O2S/c27-29(28,22-13-7-9-17-8-1-2-10-18(17)22)25-20-12-4-3-11-19(20)21-16-26-15-6-5-14-23(26)24-21/h1-4,7-13,16,25H,5-6,14-15H2.
What are the key properties of N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide?
N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide has a molecular weight of 403.51 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-sulfonamide is sourced from PubChem (CID 122283247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).