4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine

C11H18N4O — CID 79605060

IUPAC4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine
SMILESCOC(C)c1nc(N)nc(C2CCCC2)n1
InChIInChI=1S/C11H18N4O/c1-7(16-2)9-13-10(15-11(12)14-9)8-5-3-4-6-8/h7-8H,3-6H2,1-2H3,(H2,12,13,14,15)
InChIKeyBRORDTLKKRHQLM-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.82
Rot. Bonds3

About 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine

4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine (PubChem CID 79605060) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine
PubChem CID79605060
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine
SMILESCOC(C)c1nc(N)nc(C2CCCC2)n1
InChIInChI=1S/C11H18N4O/c1-7(16-2)9-13-10(15-11(12)14-9)8-5-3-4-6-8/h7-8H,3-6H2,1-2H3,(H2,12,13,14,15)
InChIKeyBRORDTLKKRHQLM-UHFFFAOYSA-N
XLogP1.82
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-cyclopentyl-6-(4-propan-2-ylcyclohexyl)-1,3,5-triazin-2-amine
CID 65401606
4-cyclohexyl-6-cyclopentyl-1,3,5-triazin-2-amine
CID 63868885
6-cyclopentyl-2-(1-methoxyethyl)pyrimidin-4-amine
CID 102551445
6-cyclohexyl-2-(1-methoxyethyl)pyrimidin-4-amine
CID 102551444
4-cyclohexyl-6-(1-ethoxybutyl)-1,3,5-triazin-2-amine
CID 116734086
4-cycloheptyl-6-(methoxymethyl)-1,3,5-triazin-2-amine
CID 63868763
4-cyclopentyl-6-(2-methoxypropan-2-yl)-1,3,5-triazin-2-amine
CID 79195361
4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63867774
4-chloro-6-cyclooctyl-1,3,5-triazin-2-amine
CID 83241557
6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 67217441
4-cycloheptyl-6-(3-methoxypropyl)-1,3,5-triazin-2-amine
CID 65093747
6-cyclopropyl-5-iodo-2-(1-methoxyethyl)pyrimidin-4-amine
CID 79617345

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine (CID 79605060) is 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine is COC(C)c1nc(N)nc(C2CCCC2)n1.
What is the InChIKey of 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine?
The InChIKey is BRORDTLKKRHQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-7(16-2)9-13-10(15-11(12)14-9)8-5-3-4-6-8/h7-8H,3-6H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine?
4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine has a molecular weight of 222.29 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-6-(1-methoxyethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 79605060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).