N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine

C12H19N5O2 — CID 2187729

IUPACN,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine
SMILESC=CCOc1nc(N(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O2/c1-4-7-19-12-14-10(16(2)3)13-11(15-12)17-5-8-18-9-6-17/h4H,1,5-9H2,2-3H3
InChIKeyXECHROHJPSLMGX-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.34
Rot. Bonds5

About N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine

N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine (PubChem CID 2187729) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine
PubChem CID2187729
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine
SMILESC=CCOc1nc(N(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O2/c1-4-7-19-12-14-10(16(2)3)13-11(15-12)17-5-8-18-9-6-17/h4H,1,5-9H2,2-3H3
InChIKeyXECHROHJPSLMGX-UHFFFAOYSA-N
XLogP0.34
TPSA63.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-allyl-N'-ethyl-6-(4-morpholinyl)-1,3,5-triazine-2,4-diamine
CID 2295099
2,6-Dimorpholin-4-yl-4-prop-2-enyloxy-1,3,5-triazine
CID 2059940
2-Allyloxy-4-morpholin-4-yl-6-piperidin-1-yl-[1,3,5]triazine
CID 2059923
2-Allyloxy-4-ethoxy-6-piperidin-1-yl-[1,3,5]triazine
CID 3286572
6-Allyloxy-2-azido-4-(morpholin-4-yl)-1,3,5-triazine
CID 129873021
2,2'-((4,6-Bis(allyloxy)-1,3,5-triazin-2-yl)imino)bisethanol
CID 53422711
4-(allyloxy)-N,N-dimethyl-6-(1-piperidinyl)-1,3,5-triazin-2-amine
CID 3601901
2,4-Dibutoxy-6-(4-morpholinyl)-1,3,5-triazine
CID 6611680
2,4-Diethoxy-6-(morpholin-4-yl)-1,3,5-triazine
CID 844067
4-(4,6-Dipropoxy-1,3,5-triazin-2-yl)-4-methylmorpholin-4-ium
CID 18420025
4-(4,6-Dipropoxy-1,3,5-triazin-2-yl)-4-ethylmorpholin-4-ium
CID 18420046
4-(4,6-Diethoxy-1,3,5-triazin-2-yl)-4-ethylmorpholin-4-ium
CID 18420048

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
The IUPAC name of N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine (CID 2187729) is N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine is C=CCOc1nc(N(C)C)nc(N2CCOCC2)n1.
What is the InChIKey of N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
The InChIKey is XECHROHJPSLMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-4-7-19-12-14-10(16(2)3)13-11(15-12)17-5-8-18-9-6-17/h4H,1,5-9H2,2-3H3.
What are the key properties of N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine has a molecular weight of 265.32 g/mol, XLogP of 0.34, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-morpholin-4-yl-6-prop-2-enoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 2187729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).