6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine

C14H23N3O — CID 107419086

IUPAC6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
SMILESCCOc1cc(NCC2CCCC2C)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-4-18-14-8-13(16-11(3)17-14)15-9-12-7-5-6-10(12)2/h8,10,12H,4-7,9H2,1-3H3,(H,15,16,17)
InChIKeyOCFLLVSNEQCAFB-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.03
Rot. Bonds5

About 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine

6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine (PubChem CID 107419086) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
PubChem CID107419086
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
SMILESCCOc1cc(NCC2CCCC2C)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-4-18-14-8-13(16-11(3)17-14)15-9-12-7-5-6-10(12)2/h8,10,12H,4-7,9H2,1-3H3,(H,15,16,17)
InChIKeyOCFLLVSNEQCAFB-UHFFFAOYSA-N
XLogP3.03
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[[(6-ethoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 66326317
N-(cyclobutylmethyl)-6-ethoxy-2-methylpyrimidin-4-amine
CID 66326683
6-N-ethyl-2-methyl-4-N-[(2-methylcyclopentyl)methyl]pyrimidine-4,6-diamine
CID 107421241
6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107419264
2-methyl-4-N-[(2-methylcyclohexyl)methyl]pyrimidine-4,6-diamine
CID 80815452
2-[[(6-methoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 66326314
N-cycloheptyl-N'-(6-ethoxy-2-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 115306618
6-ethoxy-N-(2-ethylcyclohexyl)-2-methylpyrimidin-4-amine
CID 66327527
6-ethoxy-2-methyl-N-(2-methylcyclopropyl)pyrimidin-4-amine
CID 66326709
[2-[(6-ethoxy-2-methylpyrimidin-4-yl)oxymethyl]cyclopentyl]methanamine
CID 66331092
4-methyl-N-[(2-methylcyclopentyl)methyl]-6-propoxypyrimidin-2-amine
CID 107419381
2-hydrazinyl-6-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107421322

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine (CID 107419086) is 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine is CCOc1cc(NCC2CCCC2C)nc(C)n1.
What is the InChIKey of 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
The InChIKey is OCFLLVSNEQCAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-18-14-8-13(16-11(3)17-14)15-9-12-7-5-6-10(12)2/h8,10,12H,4-7,9H2,1-3H3,(H,15,16,17).
What are the key properties of 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 107419086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).