[6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone

C17H20N4O — CID 46226045

IUPAC[6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
SMILESCc1cccc(Nc2ccc(C(=O)N3CCCCC3)cn2)n1
InChIInChI=1S/C17H20N4O/c1-13-6-5-7-16(19-13)20-15-9-8-14(12-18-15)17(22)21-10-3-2-4-11-21/h5-9,12H,2-4,10-11H2,1H3,(H,18,19,20)
InChIKeySXMKKNTZYSBWMK-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.15
Rot. Bonds3

About [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone

[6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone (PubChem CID 46226045) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
PubChem CID46226045
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name[6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
SMILESCc1cccc(Nc2ccc(C(=O)N3CCCCC3)cn2)n1
InChIInChI=1S/C17H20N4O/c1-13-6-5-7-16(19-13)20-15-9-8-14(12-18-15)17(22)21-10-3-2-4-11-21/h5-9,12H,2-4,10-11H2,1H3,(H,18,19,20)
InChIKeySXMKKNTZYSBWMK-UHFFFAOYSA-N
XLogP3.15
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone with MolForge

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Related Compounds

N-(6-methyl-2-pyridinyl)-4-(pyrrolidine-1-carbonyl)benzenesulfonamide
CID 119055428
[6-(2-fluoroanilino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 1447856
piperidin-1-yl-[6-(4-pyrrolidin-1-ylanilino)-3-pyridinyl]methanone
CID 109152366
[6-[2-(6-methyl-2-pyridinyl)ethylsulfanyl]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 166239507
azepan-1-yl-[6-(propylamino)-3-pyridinyl]methanone
CID 62172577
[6-(4-chloroanilino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 1441202
azepan-1-yl-[6-(2-propan-2-yloxyanilino)-3-pyridinyl]methanone
CID 109162030
1-[4-[4-[6-[(6-methyl-2-pyridinyl)amino]pyridazin-3-yl]piperazine-1-carbonyl]phenyl]ethanone
CID 122347231
[6-(propylamino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 60722911
[(3S)-3-[6-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]piperidin-1-yl]-phenylmethanone
CID 95814602
(4-fluorophenyl)-[4-[6-[(6-methyl-2-pyridinyl)amino]pyridazin-3-yl]piperazin-1-yl]methanone
CID 42111756
(4-bromophenyl)-[4-[6-[(6-methyl-2-pyridinyl)amino]pyridazin-3-yl]piperazin-1-yl]methanone
CID 121064797

Frequently Asked Questions

What is the IUPAC name of [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
The IUPAC name of [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone (CID 46226045) is [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone.
What is the SMILES notation for [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
The canonical SMILES for [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone is Cc1cccc(Nc2ccc(C(=O)N3CCCCC3)cn2)n1.
What is the InChIKey of [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
The InChIKey is SXMKKNTZYSBWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-13-6-5-7-16(19-13)20-15-9-8-14(12-18-15)17(22)21-10-3-2-4-11-21/h5-9,12H,2-4,10-11H2,1H3,(H,18,19,20).
What are the key properties of [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone?
[6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone has a molecular weight of 296.37 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(6-methyl-2-pyridinyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 46226045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).