6-methoxy-N,N-dimethylpyrimidin-4-amine

C7H11N3O — CID 23422081

IUPAC6-methoxy-N,N-dimethylpyrimidin-4-amine
SMILESCOc1cc(N(C)C)ncn1
InChIInChI=1S/C7H11N3O/c1-10(2)6-4-7(11-3)9-5-8-6/h4-5H,1-3H3
InChIKeySZMGWPTXDFDPOV-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.55
Rot. Bonds2

About 6-methoxy-N,N-dimethylpyrimidin-4-amine

6-methoxy-N,N-dimethylpyrimidin-4-amine (PubChem CID 23422081) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 6-methoxy-N,N-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-N,N-dimethylpyrimidin-4-amine
PubChem CID23422081
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name6-methoxy-N,N-dimethylpyrimidin-4-amine
SMILESCOc1cc(N(C)C)ncn1
InChIInChI=1S/C7H11N3O/c1-10(2)6-4-7(11-3)9-5-8-6/h4-5H,1-3H3
InChIKeySZMGWPTXDFDPOV-UHFFFAOYSA-N
XLogP0.55
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,N-dimethylpyrimidin-4-amine?
The IUPAC name of 6-methoxy-N,N-dimethylpyrimidin-4-amine (CID 23422081) is 6-methoxy-N,N-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-N,N-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-methoxy-N,N-dimethylpyrimidin-4-amine is COc1cc(N(C)C)ncn1.
What is the InChIKey of 6-methoxy-N,N-dimethylpyrimidin-4-amine?
The InChIKey is SZMGWPTXDFDPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-10(2)6-4-7(11-3)9-5-8-6/h4-5H,1-3H3.
What are the key properties of 6-methoxy-N,N-dimethylpyrimidin-4-amine?
6-methoxy-N,N-dimethylpyrimidin-4-amine has a molecular weight of 153.18 g/mol, XLogP of 0.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,N-dimethylpyrimidin-4-amine is sourced from PubChem (CID 23422081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).