N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine

C24H30N6O — CID 91615853

IUPACN-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine
SMILESCCc1cnc(N2CCC(Oc3ccc(CNc4ccc(C)nc4C)cn3)CC2)nc1
InChIInChI=1S/C24H30N6O/c1-4-19-13-27-24(28-14-19)30-11-9-21(10-12-30)31-23-8-6-20(16-26-23)15-25-22-7-5-17(2)29-18(22)3/h5-8,13-14,16,21,25H,4,9-12,15H2,1-3H3
InChIKeyMISRIKMHHUAWFU-UHFFFAOYSA-N
MW418.55 g/mol
LogP4.11
Rot. Bonds7

About N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine

N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine (PubChem CID 91615853) has the molecular formula C24H30N6O and a molecular weight of 418.55 g/mol. Its IUPAC name is N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine.

Molecular Properties

Compound NameN-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine
PubChem CID91615853
Molecular FormulaC24H30N6O
Molecular Weight418.55 g/mol
Exact Mass418.25
IUPAC NameN-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine
SMILESCCc1cnc(N2CCC(Oc3ccc(CNc4ccc(C)nc4C)cn3)CC2)nc1
InChIInChI=1S/C24H30N6O/c1-4-19-13-27-24(28-14-19)30-11-9-21(10-12-30)31-23-8-6-20(16-26-23)15-25-22-7-5-17(2)29-18(22)3/h5-8,13-14,16,21,25H,4,9-12,15H2,1-3H3
InChIKeyMISRIKMHHUAWFU-UHFFFAOYSA-N
XLogP4.11
TPSA76.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.55
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine with MolForge

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Related Compounds

2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171700905
2,6-dimethyl-N-[[5-(1-methylpiperidin-4-yl)oxypyrazin-2-yl]methyl]pyridin-3-amine
CID 90779927
2-[4-[4-(2,6-dimethyl-3-pyridinyl)phenoxy]piperidin-1-yl]-5-ethylpyrimidine
CID 91395356
N-[[4-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxyphenyl]methyl]-N,2,6-trimethylpyridin-3-amine
CID 91198410
5-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-N-(2-methyl-6-methylsulfonyl-3-pyridinyl)pyrazine-2-carboxamide
CID 46200675
tert-butyl 4-[4-[[(2,6-dimethyl-3-pyridinyl)amino]methyl]phenoxy]piperidine-1-carboxylate
CID 91229565
2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-5-ethylpyrimidine
CID 138988924
2-[4-(1,2-dihydropyridin-4-yloxy)piperidin-1-yl]-5-ethylpyrimidine
CID 142711209
5-ethyl-2-[4-[3-(4-methylphenyl)phenoxy]piperidin-1-yl]pyrimidine
CID 90810331
N-[(6-cyclopentyloxy-3-pyridinyl)methyl]-3-methyl-1,2,4-thiadiazol-5-amine
CID 133318360
tert-butyl 4-[(5-ethyl-2-pyridinyl)oxy]piperidine-1-carboxylate
CID 134497281
N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine
CID 62298054

Frequently Asked Questions

What is the IUPAC name of N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine?
The IUPAC name of N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine (CID 91615853) is N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine.
What is the SMILES notation for N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine?
The canonical SMILES for N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine is CCc1cnc(N2CCC(Oc3ccc(CNc4ccc(C)nc4C)cn3)CC2)nc1.
What is the InChIKey of N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine?
The InChIKey is MISRIKMHHUAWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O/c1-4-19-13-27-24(28-14-19)30-11-9-21(10-12-30)31-23-8-6-20(16-26-23)15-25-22-7-5-17(2)29-18(22)3/h5-8,13-14,16,21,25H,4,9-12,15H2,1-3H3.
What are the key properties of N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine?
N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine has a molecular weight of 418.55 g/mol, XLogP of 4.11, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-2,6-dimethylpyridin-3-amine is sourced from PubChem (CID 91615853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).