6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine

C11H18N4O2 — CID 114131179

IUPAC6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine
SMILESCOc1cc(NCCC2CCOC2)nc(N)n1
InChIInChI=1S/C11H18N4O2/c1-16-10-6-9(14-11(12)15-10)13-4-2-8-3-5-17-7-8/h6,8H,2-5,7H2,1H3,(H3,12,13,14,15)
InChIKeyUXWYMJODVYPIMY-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.91
Rot. Bonds5

About 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine

6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine (PubChem CID 114131179) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine
PubChem CID114131179
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine
SMILESCOc1cc(NCCC2CCOC2)nc(N)n1
InChIInChI=1S/C11H18N4O2/c1-16-10-6-9(14-11(12)15-10)13-4-2-8-3-5-17-7-8/h6,8H,2-5,7H2,1H3,(H3,12,13,14,15)
InChIKeyUXWYMJODVYPIMY-UHFFFAOYSA-N
XLogP0.91
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-methoxy-3-N-[2-(oxolan-3-yl)ethyl]benzene-1,3-diamine
CID 114129611
6-methoxy-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 103817391
4-N-dodecyl-6-methoxypyrimidine-2,4-diamine
CID 91378772
6-methoxy-4-N-nonylpyrimidine-2,4-diamine
CID 91451166
6-methoxy-4-N-nonadecylpyrimidine-2,4-diamine
CID 91279272
6-[(2-amino-6-methoxypyrimidin-4-yl)amino]hexan-1-ol
CID 114053267
2-cyclopropyl-4-[2-(oxolan-3-yl)ethylamino]-1H-pyrimidin-6-one
CID 136786682
3,5-difluoro-6-N-[2-(oxolan-3-yl)ethyl]pyridine-2,6-diamine
CID 114131324
4-N-[(1-ethylpyrrolidin-3-yl)methyl]-6-methoxypyrimidine-2,4-diamine
CID 114053019
4-N-(2-cyclohexylethyl)-6-N-ethylpyrimidine-2,4,6-triamine
CID 80791193
6-N-[2-(oxolan-3-yl)ethyl]-7H-purine-2,6-diamine
CID 104623942
3,5-dichloro-2-N-methyl-6-N-[2-(oxolan-3-yl)ethyl]pyridine-2,6-diamine
CID 114131325

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine?
The IUPAC name of 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine (CID 114131179) is 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine.
What is the SMILES notation for 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine?
The canonical SMILES for 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine is COc1cc(NCCC2CCOC2)nc(N)n1.
What is the InChIKey of 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine?
The InChIKey is UXWYMJODVYPIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-16-10-6-9(14-11(12)15-10)13-4-2-8-3-5-17-7-8/h6,8H,2-5,7H2,1H3,(H3,12,13,14,15).
What are the key properties of 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine?
6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine has a molecular weight of 238.29 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-N-[2-(oxolan-3-yl)ethyl]pyrimidine-2,4-diamine is sourced from PubChem (CID 114131179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).