1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine

C17H28N4O — CID 175810130

IUPAC1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine
SMILESCOc1nc(N2CCC(N3CCN(C)CC3)CC2)ccc1C
InChIInChI=1S/C17H28N4O/c1-14-4-5-16(18-17(14)22-3)21-8-6-15(7-9-21)20-12-10-19(2)11-13-20/h4-5,15H,6-13H2,1-3H3
InChIKeyIIWVQDOKRKALDV-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.61
Rot. Bonds3

About 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine

1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine (PubChem CID 175810130) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine.

Molecular Properties

Compound Name1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine
PubChem CID175810130
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC Name1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine
SMILESCOc1nc(N2CCC(N3CCN(C)CC3)CC2)ccc1C
InChIInChI=1S/C17H28N4O/c1-14-4-5-16(18-17(14)22-3)21-8-6-15(7-9-21)20-12-10-19(2)11-13-20/h4-5,15H,6-13H2,1-3H3
InChIKeyIIWVQDOKRKALDV-UHFFFAOYSA-N
XLogP1.61
TPSA31.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-cyclopentylpiperazin-1-yl)-2-methoxypyridin-3-amine
CID 62368609
ethane;1-methyl-4-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]piperazine
CID 144607293
2-methoxy-5-methyl-6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-N-phenylpyridin-3-amine
CID 155233764
2-[2-methoxy-5-methyl-6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-3-pyridinyl]aniline
CID 155714107
1-[1-(3-methoxyphenyl)piperidin-4-yl]-4-methylpiperazine
CID 123493648
5-bromo-N-[6-(4-cyclopropylpiperazin-1-yl)-2-methoxy-3-pyridinyl]pyrimidin-2-amine
CID 175789064
N-[2-[[5-chloro-2-[[2-methoxy-6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-3-pyridinyl]amino]pyrimidin-4-yl]-methylsulfonylamino]phenyl]methanesulfonamide
CID 165395046
1-[1-(3-bromo-6-methoxy-5-nitro-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine
CID 166872823
3-bromo-6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]imidazo[1,2-b]pyridazine
CID 169237106
3-methyl-6-[3-(4-methylpiperazin-1-yl)azetidin-1-yl]pyridazine
CID 126891751
2-(4-cyclopropylpiperazin-1-yl)-6-methoxyquinoline;dihydrochloride
CID 11302721
N-[6-[[5-chloro-2-[[2-methoxy-6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-3-pyridinyl]amino]pyrimidin-4-yl]amino]quinoxalin-5-yl]-N-cyclopropylmethanesulfonamide
CID 169278212

Frequently Asked Questions

What is the IUPAC name of 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine?
The IUPAC name of 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine (CID 175810130) is 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine.
What is the SMILES notation for 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine?
The canonical SMILES for 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine is COc1nc(N2CCC(N3CCN(C)CC3)CC2)ccc1C.
What is the InChIKey of 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine?
The InChIKey is IIWVQDOKRKALDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O/c1-14-4-5-16(18-17(14)22-3)21-8-6-15(7-9-21)20-12-10-19(2)11-13-20/h4-5,15H,6-13H2,1-3H3.
What are the key properties of 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine?
1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine has a molecular weight of 304.44 g/mol, XLogP of 1.61, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(6-methoxy-5-methyl-2-pyridinyl)piperidin-4-yl]-4-methylpiperazine is sourced from PubChem (CID 175810130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).