6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine

C20H26N4O — CID 110093923

IUPAC6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine
SMILESc1ccc(Nc2cccc(C3CCN(C4CCOCC4)CC3)n2)nc1
InChIInChI=1S/C20H26N4O/c1-2-11-21-19(5-1)23-20-6-3-4-18(22-20)16-7-12-24(13-8-16)17-9-14-25-15-10-17/h1-6,11,16-17H,7-10,12-15H2,(H,21,22,23)
InChIKeyTVXUGPSAFUXDQX-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.58
Rot. Bonds4

About 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine

6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine (PubChem CID 110093923) has the molecular formula C20H26N4O and a molecular weight of 338.45 g/mol. Its IUPAC name is 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine.

Molecular Properties

Compound Name6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine
PubChem CID110093923
Molecular FormulaC20H26N4O
Molecular Weight338.45 g/mol
Exact Mass338.21
IUPAC Name6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine
SMILESc1ccc(Nc2cccc(C3CCN(C4CCOCC4)CC3)n2)nc1
InChIInChI=1S/C20H26N4O/c1-2-11-21-19(5-1)23-20-6-3-4-18(22-20)16-7-12-24(13-8-16)17-9-14-25-15-10-17/h1-6,11,16-17H,7-10,12-15H2,(H,21,22,23)
InChIKeyTVXUGPSAFUXDQX-UHFFFAOYSA-N
XLogP3.58
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
CID 110093750
N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine
CID 110093833
(2S)-2-methyl-3-morpholin-4-yl-1-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]propan-1-one
CID 124966495
1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 124966125
N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110093855
2-(2,6-dimethylanilino)-1-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110109850
N-(1-phenylethyl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110111181
6-[1-[(2-fluorophenyl)methylsulfonyl]piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine
CID 127244691
2-[(4-fluorophenyl)methyl]-6-[1-(oxan-4-yl)piperidin-4-yl]pyridine
CID 95810440
2-[(3S)-1-(oxan-4-yl)piperidin-3-yl]pyridine
CID 95841777
N-(2-methoxy-6-methylphenyl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110109838
N-(2-methoxyphenyl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110095808

Frequently Asked Questions

What is the IUPAC name of 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine?
The IUPAC name of 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine (CID 110093923) is 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine.
What is the SMILES notation for 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine?
The canonical SMILES for 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine is c1ccc(Nc2cccc(C3CCN(C4CCOCC4)CC3)n2)nc1.
What is the InChIKey of 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine?
The InChIKey is TVXUGPSAFUXDQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-2-11-21-19(5-1)23-20-6-3-4-18(22-20)16-7-12-24(13-8-16)17-9-14-25-15-10-17/h1-6,11,16-17H,7-10,12-15H2,(H,21,22,23).
What are the key properties of 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine?
6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine has a molecular weight of 338.45 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(oxan-4-yl)piperidin-4-yl]-N-pyridin-2-ylpyridin-2-amine is sourced from PubChem (CID 110093923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).