4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine

C10H15ClN4O — CID 15926246

IUPAC4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine
SMILESC=CCOc1nc(Cl)nc(N(CC)CC)n1
InChIInChI=1S/C10H15ClN4O/c1-4-7-16-10-13-8(11)12-9(14-10)15(5-2)6-3/h4H,1,5-7H2,2-3H3
InChIKeyKSSDYIOLISWUSU-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.94
Rot. Bonds6

About 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine

4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine (PubChem CID 15926246) has the molecular formula C10H15ClN4O and a molecular weight of 242.71 g/mol. Its IUPAC name is 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine
PubChem CID15926246
Molecular FormulaC10H15ClN4O
Molecular Weight242.71 g/mol
Exact Mass242.09
IUPAC Name4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine
SMILESC=CCOc1nc(Cl)nc(N(CC)CC)n1
InChIInChI=1S/C10H15ClN4O/c1-4-7-16-10-13-8(11)12-9(14-10)15(5-2)6-3/h4H,1,5-7H2,2-3H3
InChIKeyKSSDYIOLISWUSU-UHFFFAOYSA-N
XLogP1.94
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

Cambridge id 6807868
CID 35116
6-(allyloxy)-N,N,N',N'-tetramethyl-1,3,5-triazine-2,4-diamine
CID 1819021
4-Allyloxy-6-methoxy-N,N-dimethyl-1,3,5-triazin-2-amine
CID 610855
6-(allyloxy)-N'-ethyl-N,N-dimethyl-1,3,5-triazine-2,4-diamine
CID 2055870
6-allyloxy-4-azido-N,N-dimethyl-1,3,5-triazin-2-amine
CID 129873337
4-(allyloxy)-N,N-dimethyl-6-(1-piperidinyl)-1,3,5-triazin-2-amine
CID 3601901
4-Methoxy-6-prop-2-enyloxy-2-pyrrolidinyl-1,3,5-triazine
CID 4020909
4-chloro-6-prop-2-enoxy-N-prop-2-enyl-1,3,5-triazin-2-amine
CID 20463
2,4-Bis(prop-2-enoxy)-6-pyrrolidin-1-yl-1,3,5-triazine
CID 12205825
4-chloro-6-methoxy-N,N-bis(prop-2-enyl)-1,3,5-triazin-2-amine
CID 20452222
2-(4-Methylpiperazin-1-yl)-4,6-bis(prop-2-enoxy)-1,3,5-triazine
CID 20520714
2-N,2-N,6-N-trimethoxy-4-N-(1-methoxyprop-2-enyl)-6-N-methyl-4-N-prop-2-enyl-1,3,5-triazine-2,4,6-triamine
CID 54025885

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine (CID 15926246) is 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine is C=CCOc1nc(Cl)nc(N(CC)CC)n1.
What is the InChIKey of 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
The InChIKey is KSSDYIOLISWUSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4O/c1-4-7-16-10-13-8(11)12-9(14-10)15(5-2)6-3/h4H,1,5-7H2,2-3H3.
What are the key properties of 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine?
4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine has a molecular weight of 242.71 g/mol, XLogP of 1.94, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,N-diethyl-6-prop-2-enoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 15926246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).