6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine

C11H17N3O2 — CID 80655013

IUPAC6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine
SMILESCc1cc(N)nc(COCC2CCOC2)n1
InChIInChI=1S/C11H17N3O2/c1-8-4-10(12)14-11(13-8)7-16-6-9-2-3-15-5-9/h4,9H,2-3,5-7H2,1H3,(H2,12,13,14)
InChIKeyZKYLLZHVURWHMF-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.92
Rot. Bonds4

About 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine

6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine (PubChem CID 80655013) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine
PubChem CID80655013
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine
SMILESCc1cc(N)nc(COCC2CCOC2)n1
InChIInChI=1S/C11H17N3O2/c1-8-4-10(12)14-11(13-8)7-16-6-9-2-3-15-5-9/h4,9H,2-3,5-7H2,1H3,(H2,12,13,14)
InChIKeyZKYLLZHVURWHMF-UHFFFAOYSA-N
XLogP0.92
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-2-(oxolan-3-ylmethoxymethyl)-N-propylpyrimidin-4-amine
CID 80653914
[6-methyl-2-(oxolan-3-ylmethoxy)pyrimidin-4-yl]methanamine
CID 107542654
6-methyl-2-(oxolan-3-yl)pyrimidin-4-amine
CID 62315087
3-(oxolan-3-ylmethoxymethyl)-5-(5-propan-2-yl-1,2-oxazol-3-yl)-1,2,4-oxadiazole
CID 167801830
[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]hydrazine
CID 103987906
3,6-dichloro-2-(oxolan-3-ylmethoxymethyl)pyridine
CID 62885453
[2-(oxolan-3-ylmethoxymethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62246364
5-[(5-methylfuran-2-yl)methyl]-3-(oxolan-3-ylmethoxymethyl)-1,2,4-oxadiazole
CID 131963059
2-bromo-5-(oxolan-3-ylmethoxymethyl)aniline
CID 115557537
5-chloro-N-methyl-6-(oxolan-3-ylmethoxymethyl)pyridin-2-amine
CID 62884966
6-methyl-2-(oxetan-3-ylsulfanylmethyl)pyrimidin-4-amine
CID 80654809
[4,6-dimethyl-2-(oxolan-3-ylmethoxy)-3-pyridinyl]methanol
CID 54977105

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine?
The IUPAC name of 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine (CID 80655013) is 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine is Cc1cc(N)nc(COCC2CCOC2)n1.
What is the InChIKey of 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine?
The InChIKey is ZKYLLZHVURWHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8-4-10(12)14-11(13-8)7-16-6-9-2-3-15-5-9/h4,9H,2-3,5-7H2,1H3,(H2,12,13,14).
What are the key properties of 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine?
6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine has a molecular weight of 223.28 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(oxolan-3-ylmethoxymethyl)pyrimidin-4-amine is sourced from PubChem (CID 80655013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).