4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine

C9H14N4O — CID 80681823

IUPAC4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine
SMILESCC1(c2ncnc(N)n2)CCCCO1
InChIInChI=1S/C9H14N4O/c1-9(4-2-3-5-14-9)7-11-6-12-8(10)13-7/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKeyCVQIBXRFDYAUGV-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.87
Rot. Bonds1

About 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine

4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine (PubChem CID 80681823) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine
PubChem CID80681823
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine
SMILESCC1(c2ncnc(N)n2)CCCCO1
InChIInChI=1S/C9H14N4O/c1-9(4-2-3-5-14-9)7-11-6-12-8(10)13-7/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKeyCVQIBXRFDYAUGV-UHFFFAOYSA-N
XLogP0.87
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine
CID 80681720
4-(chloromethyl)-2-(2-methyloxan-2-yl)pyrimidine
CID 80680631
2-(2-methyloxan-2-yl)pyrimidine-4-carboxylic acid
CID 80681647
6-ethyl-5-iodo-2-(2-methyloxan-2-yl)pyrimidin-4-amine
CID 80680945
2-(2-methyloxan-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 80680939
N-methyl-1-[5-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-yl]methanamine
CID 114245206
2-(2-methyloxan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 80681411
N-methyl-1-[4-methyl-2-(2-methyloxan-2-yl)pyrimidin-5-yl]ethanamine
CID 80681424
2-[3-(2-methyloxan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
CID 104743065
5-bromo-2-(2-methyloxan-2-yl)-6-phenylpyrimidin-4-amine
CID 80683733
5-bromo-6-cyclopropyl-2-(2-methyloxan-2-yl)pyrimidin-4-amine
CID 80681182
5-bromo-2-(2-methyloxan-2-yl)-6-propylpyrimidin-4-amine
CID 80681180

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine (CID 80681823) is 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine is CC1(c2ncnc(N)n2)CCCCO1.
What is the InChIKey of 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is CVQIBXRFDYAUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-9(4-2-3-5-14-9)7-11-6-12-8(10)13-7/h6H,2-5H2,1H3,(H2,10,11,12,13).
What are the key properties of 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine?
4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 194.24 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyloxan-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80681823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).