4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine

C12H21N5O3 — CID 62861950

IUPAC4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NC(C)CN2CCOCC2)nc(OC)n1
InChIInChI=1S/C12H21N5O3/c1-9(8-17-4-6-20-7-5-17)13-10-14-11(18-2)16-12(15-10)19-3/h9H,4-8H2,1-3H3,(H,13,14,15,16)
InChIKeyJGGVCRRBGHKSCW-UHFFFAOYSA-N
MW283.33 g/mol
LogP0.02
Rot. Bonds6

About 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine

4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine (PubChem CID 62861950) has the molecular formula C12H21N5O3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
PubChem CID62861950
Molecular FormulaC12H21N5O3
Molecular Weight283.33 g/mol
Exact Mass283.16
IUPAC Name4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NC(C)CN2CCOCC2)nc(OC)n1
InChIInChI=1S/C12H21N5O3/c1-9(8-17-4-6-20-7-5-17)13-10-14-11(18-2)16-12(15-10)19-3/h9H,4-8H2,1-3H3,(H,13,14,15,16)
InChIKeyJGGVCRRBGHKSCW-UHFFFAOYSA-N
XLogP0.02
TPSA81.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4-ethoxy-6-hydrazinyl-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 80901228
6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80800739
4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine
CID 112685180
5,6-diethyl-N-(1-morpholin-4-ylpropan-2-yl)-1,2,4-triazin-3-amine
CID 105362530
6-chloro-2-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2,4-diamine
CID 104918892
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyrazin-2-amine
CID 47370622
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 63586349
N-(2,2-dimethoxyethyl)-1-morpholin-4-ylpropan-2-amine
CID 63684989
4-(4-chlorophenyl)-N-(1-morpholin-4-ylpropan-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 44821870
3-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)butane-1,3-diamine
CID 83178530
1-(4-methoxyphenyl)-N-(1-morpholin-4-ylpropan-2-yl)propan-2-amine
CID 43675935
6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80777051

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine (CID 62861950) is 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine is COc1nc(NC(C)CN2CCOCC2)nc(OC)n1.
What is the InChIKey of 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is JGGVCRRBGHKSCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O3/c1-9(8-17-4-6-20-7-5-17)13-10-14-11(18-2)16-12(15-10)19-3/h9H,4-8H2,1-3H3,(H,13,14,15,16).
What are the key properties of 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine?
4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 283.33 g/mol, XLogP of 0.02, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 62861950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).