N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine

C19H19N5S — CID 145104480

IUPACN-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine
SMILESC=Nc1nc(C2CCCN(c3cccc(-c4ccccn4)n3)C2)cs1
InChIInChI=1S/C19H19N5S/c1-20-19-23-17(13-25-19)14-6-5-11-24(12-14)18-9-4-8-16(22-18)15-7-2-3-10-21-15/h2-4,7-10,13-14H,1,5-6,11-12H2
InChIKeyMOJIIYXBDCTDMF-UHFFFAOYSA-N
MW349.46 g/mol
LogP4.32
Rot. Bonds4

About N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine

N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine (PubChem CID 145104480) has the molecular formula C19H19N5S and a molecular weight of 349.46 g/mol. Its IUPAC name is N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine.

Molecular Properties

Compound NameN-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine
PubChem CID145104480
Molecular FormulaC19H19N5S
Molecular Weight349.46 g/mol
Exact Mass349.14
IUPAC NameN-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine
SMILESC=Nc1nc(C2CCCN(c3cccc(-c4ccccn4)n3)C2)cs1
InChIInChI=1S/C19H19N5S/c1-20-19-23-17(13-25-19)14-6-5-11-24(12-14)18-9-4-8-16(22-18)15-7-2-3-10-21-15/h2-4,7-10,13-14H,1,5-6,11-12H2
InChIKeyMOJIIYXBDCTDMF-UHFFFAOYSA-N
XLogP4.32
TPSA54.27 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine with MolForge

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Related Compounds

1,3-diazinane;ethane;[1-[6-[2-(methylideneamino)-1,3-thiazol-4-yl]-2-pyridinyl]piperidin-3-yl]methanol
CID 145105083
4-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]-1,3-thiazol-2-amine
CID 95829128
4-(1-pyridin-2-ylpiperidin-3-yl)pyrimidine
CID 122602482
2-[(3S)-3-pyridin-2-ylpiperidin-1-yl]pyrazine
CID 95817344
N-[4-[6-[2-(3-fluorophenyl)morpholin-4-yl]-2-pyridinyl]-1,3-thiazol-2-yl]methanimine
CID 145104362
2-[3-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine
CID 110254065
2-(3-pyrazol-1-ylpiperidin-1-yl)pyridine
CID 133287338
[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
CID 116972449
[1-(4-pyridin-2-ylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 103278821
1-[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidine-3-carboxylic acid
CID 56770146
3-ethyl-5-[(3S)-3-pyridin-2-ylpiperidin-1-yl]-1,2,4-thiadiazole
CID 125423818
N-methyl-6-[(3R)-1-(2-methylpyrimidin-4-yl)piperidin-3-yl]pyridin-2-amine
CID 95824516

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine?
The IUPAC name of N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine (CID 145104480) is N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine.
What is the SMILES notation for N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine?
The canonical SMILES for N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine is C=Nc1nc(C2CCCN(c3cccc(-c4ccccn4)n3)C2)cs1.
What is the InChIKey of N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine?
The InChIKey is MOJIIYXBDCTDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5S/c1-20-19-23-17(13-25-19)14-6-5-11-24(12-14)18-9-4-8-16(22-18)15-7-2-3-10-21-15/h2-4,7-10,13-14H,1,5-6,11-12H2.
What are the key properties of N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine?
N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine has a molecular weight of 349.46 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(6-pyridin-2-yl-2-pyridinyl)piperidin-3-yl]-1,3-thiazol-2-yl]methanimine is sourced from PubChem (CID 145104480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).