N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine

C19H25N5O2S — CID 110093833

IUPACN-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine
SMILESO=S(=O)(N1CCCC1)N1CCC(c2cccc(Nc3ccccn3)n2)CC1
InChIInChI=1S/C19H25N5O2S/c25-27(26,23-12-3-4-13-23)24-14-9-16(10-15-24)17-6-5-8-19(21-17)22-18-7-1-2-11-20-18/h1-2,5-8,11,16H,3-4,9-10,12-15H2,(H,20,21,22)
InChIKeyYKXPSRJBGDEUMG-UHFFFAOYSA-N
MW387.51 g/mol
LogP2.74
Rot. Bonds5

About N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine

N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine (PubChem CID 110093833) has the molecular formula C19H25N5O2S and a molecular weight of 387.51 g/mol. Its IUPAC name is N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine
PubChem CID110093833
Molecular FormulaC19H25N5O2S
Molecular Weight387.51 g/mol
Exact Mass387.17
IUPAC NameN-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine
SMILESO=S(=O)(N1CCCC1)N1CCC(c2cccc(Nc3ccccn3)n2)CC1
InChIInChI=1S/C19H25N5O2S/c25-27(26,23-12-3-4-13-23)24-14-9-16(10-15-24)17-6-5-8-19(21-17)22-18-7-1-2-11-20-18/h1-2,5-8,11,16H,3-4,9-10,12-15H2,(H,20,21,22)
InChIKeyYKXPSRJBGDEUMG-UHFFFAOYSA-N
XLogP2.74
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.51
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[1-[(2-fluorophenyl)methylsulfonyl]piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine
CID 127244691
6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine
CID 110093923
1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 124966125
2-(2,6-dimethylanilino)-1-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110109850
6-(1-methylsulfonylpiperidin-3-yl)-N-pyridin-2-ylpyrazin-2-amine
CID 110252903
(2S)-2-methyl-3-morpholin-4-yl-1-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]propan-1-one
CID 124966495
N-(3-methyl-2-pyridinyl)-6-(1-morpholin-4-ylsulfonylpiperidin-3-yl)pyridin-2-amine
CID 110265497
N-(1-phenylethyl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110111181
4,6-dimethyl-N-[6-(1-methylsulfonylpiperidin-4-yl)-2-pyridinyl]pyrimidin-2-amine
CID 110093805
N-(6-methyl-2-pyridinyl)-6-(1-morpholin-4-ylsulfonylpiperidin-4-yl)pyrazin-2-amine
CID 110094133
(3S)-N,N-dimethyl-3-[4-methyl-6-(pyridin-2-ylamino)pyrimidin-2-yl]pyrrolidine-1-sulfonamide
CID 95842363
4-pyridin-2-ylpiperidine-1-sulfonamide
CID 91607486

Frequently Asked Questions

What is the IUPAC name of N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine (CID 110093833) is N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine is O=S(=O)(N1CCCC1)N1CCC(c2cccc(Nc3ccccn3)n2)CC1.
What is the InChIKey of N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is YKXPSRJBGDEUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2S/c25-27(26,23-12-3-4-13-23)24-14-9-16(10-15-24)17-6-5-8-19(21-17)22-18-7-1-2-11-20-18/h1-2,5-8,11,16H,3-4,9-10,12-15H2,(H,20,21,22).
What are the key properties of N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine?
N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 387.51 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 110093833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).