1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine

C15H19N5 — CID 123270293

IUPAC1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine
SMILESC/N=C/c1c(C)nc(C)nc1CCc1nccnc1C
InChIInChI=1S/C15H19N5/c1-10-13(9-16-4)15(20-12(3)19-10)6-5-14-11(2)17-7-8-18-14/h7-9H,5-6H2,1-4H3/b16-9+
InChIKeyXVNDVFCMFCVXGY-CXUHLZMHSA-N
MW269.35 g/mol
LogP2.03
Rot. Bonds4

About 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine

1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine (PubChem CID 123270293) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine.

Molecular Properties

Compound Name1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine
PubChem CID123270293
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine
SMILESC/N=C/c1c(C)nc(C)nc1CCc1nccnc1C
InChIInChI=1S/C15H19N5/c1-10-13(9-16-4)15(20-12(3)19-10)6-5-14-11(2)17-7-8-18-14/h7-9H,5-6H2,1-4H3/b16-9+
InChIKeyXVNDVFCMFCVXGY-CXUHLZMHSA-N
XLogP2.03
TPSA63.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine?
The IUPAC name of 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine (CID 123270293) is 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine.
What is the SMILES notation for 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine?
The canonical SMILES for 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine is C/N=C/c1c(C)nc(C)nc1CCc1nccnc1C.
What is the InChIKey of 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine?
The InChIKey is XVNDVFCMFCVXGY-CXUHLZMHSA-N. The full InChI is InChI=1S/C15H19N5/c1-10-13(9-16-4)15(20-12(3)19-10)6-5-14-11(2)17-7-8-18-14/h7-9H,5-6H2,1-4H3/b16-9+.
What are the key properties of 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine?
1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine has a molecular weight of 269.35 g/mol, XLogP of 2.03, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,4-dimethyl-6-[2-(3-methylpyrazin-2-yl)ethyl]pyrimidin-5-yl]-N-methylmethanimine is sourced from PubChem (CID 123270293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).