2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine

C14H21N5O — CID 3238055

IUPAC2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine
SMILESC=CCOc1nc(N2CCCC2)nc(N2CCCC2)n1
InChIInChI=1S/C14H21N5O/c1-2-11-20-14-16-12(18-7-3-4-8-18)15-13(17-14)19-9-5-6-10-19/h2H,1,3-11H2
InChIKeyZLBRIFGXLPPRNW-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.64
Rot. Bonds5

About 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine

2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine (PubChem CID 3238055) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine
PubChem CID3238055
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine
SMILESC=CCOc1nc(N2CCCC2)nc(N2CCCC2)n1
InChIInChI=1S/C14H21N5O/c1-2-11-20-14-16-12(18-7-3-4-8-18)15-13(17-14)19-9-5-6-10-19/h2H,1,3-11H2
InChIKeyZLBRIFGXLPPRNW-UHFFFAOYSA-N
XLogP1.64
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-Methoxy-6-prop-2-enyloxy-2-pyrrolidinyl-1,3,5-triazine
CID 4020909
2,4-Bis(prop-2-enoxy)-6-pyrrolidin-1-yl-1,3,5-triazine
CID 12205825
6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 89303275
4,6-bis(prop-2-enoxy)-N,N-bis(prop-2-enyl)-1,3,5-triazin-2-amine
CID 89303320
2-Chloro-4-prop-2-enoxy-6-pyrrolidin-1-yl-1,3,5-triazine
CID 62868757
2-But-2-enoxy-4-chloro-6-pyrrolidin-1-yl-1,3,5-triazine
CID 76951030
4-Prop-2-enoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80867785
N-ethyl-4-prop-2-enoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80868376
4-prop-2-enoxy-N-propyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80868699
N-methyl-4-prop-2-enoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80868779
4-[(E)-but-2-enoxy]-N-propyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80872622
4-[(E)-but-2-enoxy]-N-ethyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80872640

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine?
The IUPAC name of 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine (CID 3238055) is 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine.
What is the SMILES notation for 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine?
The canonical SMILES for 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine is C=CCOc1nc(N2CCCC2)nc(N2CCCC2)n1.
What is the InChIKey of 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine?
The InChIKey is ZLBRIFGXLPPRNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-2-11-20-14-16-12(18-7-3-4-8-18)15-13(17-14)19-9-5-6-10-19/h2H,1,3-11H2.
What are the key properties of 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine?
2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine has a molecular weight of 275.36 g/mol, XLogP of 1.64, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enoxy-4,6-dipyrrolidin-1-yl-1,3,5-triazine is sourced from PubChem (CID 3238055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).