N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide

C14H13N3O2S — CID 169029432

IUPACN-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1ccc2[nH]ccc2c1)c1cccnc1
InChIInChI=1S/C14H13N3O2S/c18-20(19,13-2-1-6-15-10-13)17-9-11-3-4-14-12(8-11)5-7-16-14/h1-8,10,16-17H,9H2
InChIKeyNLYQVZAQVVKIOH-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.04
Rot. Bonds4

About N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide

N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide (PubChem CID 169029432) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide
PubChem CID169029432
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC NameN-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1ccc2[nH]ccc2c1)c1cccnc1
InChIInChI=1S/C14H13N3O2S/c18-20(19,13-2-1-6-15-10-13)17-9-11-3-4-14-12(8-11)5-7-16-14/h1-8,10,16-17H,9H2
InChIKeyNLYQVZAQVVKIOH-UHFFFAOYSA-N
XLogP2.04
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(1H-indol-6-ylmethyl)benzenesulfonamide
CID 169029479
N-[[4-(difluoromethoxy)phenyl]methyl]pyridine-3-sulfonamide
CID 3823851
N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 91625946
N-[(2-pyridin-4-yl-4-pyridinyl)methyl]pyridine-3-sulfonamide
CID 121018139
4-(4-chloro-2,3-dimethyl-5-oxopyrazol-1-yl)-N-(1H-indol-5-ylmethyl)benzenesulfonamide
CID 142750262
N-methyl-N-[4-[(pyridin-3-ylsulfonylamino)methyl]phenyl]butanamide
CID 141287527
N-(1H-indol-5-ylmethyl)-4-methylpiperidine-1-sulfonamide
CID 169029487
N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
CID 110865640
N-(1H-indol-6-ylmethyl)-2-pyridin-3-ylethanamine
CID 102909982
1-(1H-indol-5-yl)-N-[(3-methyl-2-pyridinyl)methyl]methanamine
CID 102910898
N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridine-3-sulfonamide
CID 54896202
4-(2-chloroethyl)-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 28719352

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide (CID 169029432) is N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide is O=S(=O)(NCc1ccc2[nH]ccc2c1)c1cccnc1.
What is the InChIKey of N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is NLYQVZAQVVKIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c18-20(19,13-2-1-6-15-10-13)17-9-11-3-4-14-12(8-11)5-7-16-14/h1-8,10,16-17H,9H2.
What are the key properties of N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide?
N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 287.34 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 169029432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).