6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine

C10H16N4O2 — CID 103817391

IUPAC6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
SMILESCOc1cc(NCC2CCCO2)nc(N)n1
InChIInChI=1S/C10H16N4O2/c1-15-9-5-8(13-10(11)14-9)12-6-7-3-2-4-16-7/h5,7H,2-4,6H2,1H3,(H3,11,12,13,14)
InChIKeyNYUCVPWEBZRMGN-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.66
Rot. Bonds4

About 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine

6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine (PubChem CID 103817391) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
PubChem CID103817391
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
SMILESCOc1cc(NCC2CCCO2)nc(N)n1
InChIInChI=1S/C10H16N4O2/c1-15-9-5-8(13-10(11)14-9)12-6-7-3-2-4-16-7/h5,7H,2-4,6H2,1H3,(H3,11,12,13,14)
InChIKeyNYUCVPWEBZRMGN-UHFFFAOYSA-N
XLogP0.66
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 23993069
6-methoxy-2-N-(oxolan-2-ylmethyl)pyridine-2,5-diamine
CID 43261205
4-N-methyl-6-(oxolan-2-ylmethoxy)pyrimidine-2,4-diamine
CID 80859711
6-ethoxy-2-ethyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
CID 82453883
4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 80772162
2-tert-butyl-6-(2-methoxyethoxy)-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
CID 82456935
6-methoxy-2-N-(oxan-2-ylmethyl)pyridine-2,3-diamine
CID 113286504
4-N-[(1-ethylpiperidin-2-yl)methyl]-6-methoxypyrimidine-2,4-diamine
CID 134708598
2-ethyl-6-hydrazinyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
CID 80938700
6-methyl-N-(oxolan-2-ylmethyl)-2-propan-2-ylpyrimidin-4-amine
CID 43395188
4-N-[2-(oxolan-2-yl)ethyl]-6-N-propylpyrimidine-2,4,6-triamine
CID 80811963
6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine
CID 114131179

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine?
The IUPAC name of 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine (CID 103817391) is 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine is COc1cc(NCC2CCCO2)nc(N)n1.
What is the InChIKey of 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine?
The InChIKey is NYUCVPWEBZRMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-15-9-5-8(13-10(11)14-9)12-6-7-3-2-4-16-7/h5,7H,2-4,6H2,1H3,(H3,11,12,13,14).
What are the key properties of 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine?
6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine has a molecular weight of 224.26 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 103817391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).