4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine

C13H20N4O — CID 116781962

IUPAC4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine
SMILESCCOC1(c2nc(N)nc(C3CC3)n2)CCCC1
InChIInChI=1S/C13H20N4O/c1-2-18-13(7-3-4-8-13)11-15-10(9-5-6-9)16-12(14)17-11/h9H,2-8H2,1H3,(H2,14,15,16,17)
InChIKeyAAWHEMOBIRJPKQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.14
Rot. Bonds4

About 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine

4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine (PubChem CID 116781962) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine
PubChem CID116781962
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine
SMILESCCOC1(c2nc(N)nc(C3CC3)n2)CCCC1
InChIInChI=1S/C13H20N4O/c1-2-18-13(7-3-4-8-13)11-15-10(9-5-6-9)16-12(14)17-11/h9H,2-8H2,1H3,(H2,14,15,16,17)
InChIKeyAAWHEMOBIRJPKQ-UHFFFAOYSA-N
XLogP2.14
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1-ethoxycycloheptyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 116781933
6-cyclopropyl-2-(1-ethoxycycloheptyl)pyrimidin-4-amine
CID 116776273
6-cyclopropyl-2-(1-ethoxycycloheptyl)-5-iodopyrimidin-4-amine
CID 116777204
4-cyclohexyl-6-(4-methoxyoxan-4-yl)-1,3,5-triazin-2-amine
CID 116782007
4-(1-ethoxy-4-methylcyclohexyl)-6-propyl-1,3,5-triazin-2-amine
CID 116781918
cis-(1S,3R)-3-[3-(1-ethoxycyclohexyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 106323609
2-(1-ethoxycyclopentyl)pyrimidin-4-amine
CID 116775700
5-(bromomethyl)-4-cyclopropyl-2-(1-ethoxycyclopentyl)pyrimidine
CID 114205823
2-(1-ethoxycycloheptyl)-5-iodo-6-propylpyrimidin-4-amine
CID 116776648
5-bromo-2-(1-ethoxycyclohexyl)-6-propan-2-ylpyrimidin-4-amine
CID 116776851
4-ethyl-6-(1-methoxycyclopentyl)-1,3,5-triazin-2-amine
CID 104612085
4-ethyl-6-(1-methoxycyclobutyl)-1,3,5-triazin-2-amine
CID 116734026

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine (CID 116781962) is 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine is CCOC1(c2nc(N)nc(C3CC3)n2)CCCC1.
What is the InChIKey of 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine?
The InChIKey is AAWHEMOBIRJPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-18-13(7-3-4-8-13)11-15-10(9-5-6-9)16-12(14)17-11/h9H,2-8H2,1H3,(H2,14,15,16,17).
What are the key properties of 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine?
4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine has a molecular weight of 248.33 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-6-(1-ethoxycyclopentyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 116781962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).