N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine

C20H22N4O — CID 56563768

IUPACN-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCOc1ccccc1CCNc1nc(-c2ccccn2)nc(C)c1C
InChIInChI=1S/C20H22N4O/c1-14-15(2)23-20(17-9-6-7-12-21-17)24-19(14)22-13-11-16-8-4-5-10-18(16)25-3/h4-10,12H,11,13H2,1-3H3,(H,22,23,24)
InChIKeyJUZOEHJCXKMFKE-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.82
Rot. Bonds6

About N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine

N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 56563768) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID56563768
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCOc1ccccc1CCNc1nc(-c2ccccn2)nc(C)c1C
InChIInChI=1S/C20H22N4O/c1-14-15(2)23-20(17-9-6-7-12-21-17)24-19(14)22-13-11-16-8-4-5-10-18(16)25-3/h4-10,12H,11,13H2,1-3H3,(H,22,23,24)
InChIKeyJUZOEHJCXKMFKE-UHFFFAOYSA-N
XLogP3.82
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-chlorophenyl)methyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56564118
N-[(2-methoxyphenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56584629
5,6-dimethyl-2-pyridin-2-yl-N-[[2-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrimidin-4-amine
CID 133291008
N-[2-(2-methoxyphenyl)ethyl]-3-pyridin-2-yl-1,2,4-oxadiazole-5-carboxamide
CID 42581632
N-(8-methoxy-3,4-dihydro-2H-chromen-3-yl)-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 133294514
2-[2-(2-methoxyphenyl)ethylamino]-4-methylpyridine-3-carbothioamide
CID 106261389
4-[[(5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]methyl]-N-methylbenzamide
CID 133290912
N-[(2-fluorophenyl)methyl]-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine
CID 70697151
5-hydroxy-N-[2-(2-methoxyphenyl)ethyl]-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxamide
CID 136599306
5-bromo-6-hydrazinyl-N-[2-(2-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 106262742
N-[1-[(3-fluoro-4-methoxyphenyl)methyl]piperidin-4-yl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56563974
N-[1-(4-ethoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56585256

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine (CID 56563768) is N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine is COc1ccccc1CCNc1nc(-c2ccccn2)nc(C)c1C.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is JUZOEHJCXKMFKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-14-15(2)23-20(17-9-6-7-12-21-17)24-19(14)22-13-11-16-8-4-5-10-18(16)25-3/h4-10,12H,11,13H2,1-3H3,(H,22,23,24).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine?
N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 334.42 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 56563768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).