4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine

C12H21N5O2 — CID 80789305

IUPAC4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(N2CCOCC2CC)n1
InChIInChI=1S/C12H21N5O2/c1-3-6-19-12-15-10(13)14-11(16-12)17-5-7-18-8-9(17)4-2/h9H,3-8H2,1-2H3,(H2,13,14,15,16)
InChIKeyHINHZGDMDYIYQD-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.86
Rot. Bonds5

About 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine

4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80789305) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80789305
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(N2CCOCC2CC)n1
InChIInChI=1S/C12H21N5O2/c1-3-6-19-12-15-10(13)14-11(16-12)17-5-7-18-8-9(17)4-2/h9H,3-8H2,1-2H3,(H2,13,14,15,16)
InChIKeyHINHZGDMDYIYQD-UHFFFAOYSA-N
XLogP0.86
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(2-methylpyrrolidin-1-yl)-6-propoxy-1,3,5-triazin-2-amine
CID 80791929
4-hexoxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80862100
(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 175844619
4-[4-(cyclopropylmethyl)piperazin-1-yl]-6-propoxy-1,3,5-triazin-2-amine
CID 80779052
4-(3,5-dimethyl-1,2,4-triazol-1-yl)-6-propoxy-1,3,5-triazin-2-amine
CID 80857105
1-(4-amino-6-propoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-ol
CID 81108978
4-(4-amino-6-methoxy-1,3,5-triazin-2-yl)morpholine-3-carboxamide
CID 83095941
4-(3-ethylmorpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114564205
6-(3-ethylmorpholin-4-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80789304
5-(3-ethylmorpholin-4-yl)pyrazin-2-amine
CID 80653385
4-(6-chloro-2-pyridinyl)-3-ethylmorpholine
CID 63585973
2-N-ethyl-6-(3-ethylmorpholin-4-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80789841

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine (CID 80789305) is 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(N)nc(N2CCOCC2CC)n1.
What is the InChIKey of 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is HINHZGDMDYIYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-3-6-19-12-15-10(13)14-11(16-12)17-5-7-18-8-9(17)4-2/h9H,3-8H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine?
4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 267.33 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethylmorpholin-4-yl)-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80789305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).