4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine

C11H20N4O — CID 116734056

IUPAC4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCCOC(CC)c1nc(N)nc(C(C)C)n1
InChIInChI=1S/C11H20N4O/c1-5-8(16-6-2)10-13-9(7(3)4)14-11(12)15-10/h7-8H,5-6H2,1-4H3,(H2,12,13,14,15)
InChIKeyHAKPWNPRDPPXIL-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.06
Rot. Bonds5

About 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine

4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 116734056) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID116734056
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCCOC(CC)c1nc(N)nc(C(C)C)n1
InChIInChI=1S/C11H20N4O/c1-5-8(16-6-2)10-13-9(7(3)4)14-11(12)15-10/h7-8H,5-6H2,1-4H3,(H2,12,13,14,15)
InChIKeyHAKPWNPRDPPXIL-UHFFFAOYSA-N
XLogP2.06
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-ethoxypropyl)-6-ethyl-5-methylpyrimidin-4-amine
CID 116729178
5-bromo-2-(1-ethoxypropyl)-6-methylpyrimidin-4-amine
CID 116729296
5-bromo-2-(1-ethoxypropyl)-6-propylpyrimidin-4-amine
CID 116729378
6-cyclopropyl-2-(1-ethoxypropyl)pyrimidin-4-amine
CID 116729139
(1S,2S)-1-[3-(1-ethoxypropyl)-1,2,4-oxadiazol-5-yl]-2-methylbutan-1-amine
CID 104900343
2-N-ethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 130532627
2-(1-ethoxypropyl)-7H-purin-6-amine
CID 174819126
[2-(1-ethoxypropyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 116730430
4-(1-ethoxyethyl)-6-propyl-1,3,5-triazin-2-amine
CID 64535056
4-cyclohexyl-6-(1-ethoxybutyl)-1,3,5-triazin-2-amine
CID 116734086
4-(1-ethoxycycloheptyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 116781933
2-[3-(1-ethoxypropyl)-1,2,4-oxadiazol-5-yl]pentan-3-one
CID 116732543

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine (CID 116734056) is 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine is CCOC(CC)c1nc(N)nc(C(C)C)n1.
What is the InChIKey of 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is HAKPWNPRDPPXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-5-8(16-6-2)10-13-9(7(3)4)14-11(12)15-10/h7-8H,5-6H2,1-4H3,(H2,12,13,14,15).
What are the key properties of 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine?
4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 224.31 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethoxypropyl)-6-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 116734056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).