4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine

C11H18N4O — CID 107425506

IUPAC4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine
SMILESCOc1cc(C)nc(NC2(C)CCNC2)n1
InChIInChI=1S/C11H18N4O/c1-8-6-9(16-3)14-10(13-8)15-11(2)4-5-12-7-11/h6,12H,4-5,7H2,1-3H3,(H,13,14,15)
InChIKeyCMPFMYBIXFKPBT-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.96
Rot. Bonds3

About 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine

4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine (PubChem CID 107425506) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine
PubChem CID107425506
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine
SMILESCOc1cc(C)nc(NC2(C)CCNC2)n1
InChIInChI=1S/C11H18N4O/c1-8-6-9(16-3)14-10(13-8)15-11(2)4-5-12-7-11/h6,12H,4-5,7H2,1-3H3,(H,13,14,15)
InChIKeyCMPFMYBIXFKPBT-UHFFFAOYSA-N
XLogP0.96
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine
CID 107425678
4-methyl-N-(4-methylpiperidin-4-yl)-6-propan-2-yloxypyrimidin-2-amine
CID 114697237
5-methoxy-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine
CID 107425446
6-methoxy-N-(3-methylpyrrolidin-3-yl)pyrazin-2-amine
CID 107425331
4-methoxy-N-(4-methylpiperidin-4-yl)pyrimidin-2-amine
CID 114696985
4-methyl-N-(3-methylpyrrolidin-3-yl)-1,3-thiazol-2-amine
CID 107425466
2,6-dimethyl-4-[(3-methylpyrrolidin-3-yl)amino]pyridine-3-carboxamide
CID 107425347
N-[1-(chloromethyl)-4-methylcyclohexyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 112635634
5-iodo-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine
CID 107426009
N-[(1-ethylcyclopentyl)methyl]-4-methoxy-6-methylpyrimidin-2-amine
CID 114125759
N-(4-methoxy-6-methylpyrimidin-2-yl)azepan-3-amine
CID 112634935
[1-[(4-methoxy-6-methylpyrimidin-2-yl)amino]-3-methylcyclohexyl]methanol
CID 112637527

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine?
The IUPAC name of 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine (CID 107425506) is 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine is COc1cc(C)nc(NC2(C)CCNC2)n1.
What is the InChIKey of 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine?
The InChIKey is CMPFMYBIXFKPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8-6-9(16-3)14-10(13-8)15-11(2)4-5-12-7-11/h6,12H,4-5,7H2,1-3H3,(H,13,14,15).
What are the key properties of 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine?
4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine has a molecular weight of 222.29 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-methyl-N-(3-methylpyrrolidin-3-yl)pyrimidin-2-amine is sourced from PubChem (CID 107425506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).