4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine

C14H18N4O — CID 5066040

IUPAC4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine
SMILESCCOc1cc(C)nc(NCCc2ccncc2)n1
InChIInChI=1S/C14H18N4O/c1-3-19-13-10-11(2)17-14(18-13)16-9-6-12-4-7-15-8-5-12/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,16,17,18)
InChIKeyRVXHERALSMHEBE-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.23
Rot. Bonds6

About 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine

4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine (PubChem CID 5066040) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine
PubChem CID5066040
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine
SMILESCCOc1cc(C)nc(NCCc2ccncc2)n1
InChIInChI=1S/C14H18N4O/c1-3-19-13-10-11(2)17-14(18-13)16-9-6-12-4-7-15-8-5-12/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,16,17,18)
InChIKeyRVXHERALSMHEBE-UHFFFAOYSA-N
XLogP2.23
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N'-(4-ethoxy-6-methylpyrimidin-2-yl)-N-ethylethane-1,2-diamine
CID 112634830
4-ethoxy-6-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrimidin-2-amine
CID 103007614
4-ethoxy-6-methyl-N-(2-methylsulfanylethyl)pyrimidin-2-amine
CID 112637746
N-[2-(4-aminophenyl)ethyl]-4-methyl-6-propoxypyrimidin-2-amine
CID 115973398
4-[(4-ethoxy-6-methylpyrimidin-2-yl)amino]butan-1-ol
CID 106842653
4-ethoxy-6-methyl-N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]pyrimidin-2-amine
CID 107489048
4-ethoxy-N-(5-methoxypentyl)-6-methylpyrimidin-2-amine
CID 114131177
4-ethoxy-6-methyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 112636547
4-ethoxy-6-methyl-N-prop-2-ynylpyrimidin-2-amine
CID 112637451
4-ethoxy-N-(2-phenylethyl)pyrimidin-2-amine
CID 112636504
4-ethoxy-6-methyl-N-(5-methylsulfanylpentyl)pyrimidin-2-amine
CID 114127734
N-(2-chloropropyl)-4-ethoxy-6-methylpyrimidin-2-amine
CID 112635580

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine?
The IUPAC name of 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine (CID 5066040) is 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine?
The canonical SMILES for 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine is CCOc1cc(C)nc(NCCc2ccncc2)n1.
What is the InChIKey of 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine?
The InChIKey is RVXHERALSMHEBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-3-19-13-10-11(2)17-14(18-13)16-9-6-12-4-7-15-8-5-12/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,16,17,18).
What are the key properties of 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine?
4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine has a molecular weight of 258.32 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-methyl-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine is sourced from PubChem (CID 5066040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).