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

C9H15ClN4O — CID 62857212

IUPAC4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(Cl)nc(N(CC)CC)n1
InChIInChI=1S/C9H15ClN4O/c1-4-14(5-2)8-11-7(10)12-9(13-8)15-6-3/h4-6H2,1-3H3
InChIKeyZBXKBNAKAZFHSS-UHFFFAOYSA-N
MW230.70 g/mol
LogP1.77
Rot. Bonds5

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

4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine (PubChem CID 62857212) has the molecular formula C9H15ClN4O and a molecular weight of 230.70 g/mol. Its IUPAC name is 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine
PubChem CID62857212
Molecular FormulaC9H15ClN4O
Molecular Weight230.70 g/mol
Exact Mass230.09
IUPAC Name4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(Cl)nc(N(CC)CC)n1
InChIInChI=1S/C9H15ClN4O/c1-4-14(5-2)8-11-7(10)12-9(13-8)15-6-3/h4-6H2,1-3H3
InChIKeyZBXKBNAKAZFHSS-UHFFFAOYSA-N
XLogP1.77
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.70
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,5-Triazine-2,4-diamine, N,N,N',N'-tetraethyl-6-methoxy-
CID 27285
4-chloro-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
CID 20857
6-chloro-2-N,2-N,4-N,4-N-tetrakis(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
CID 21697874
4-(2-Bromoethoxy)-N,N-diethyl-6-fluoro-1,3,5-triazin-2-amine
CID 14029063
4-chloro-N,N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine
CID 62870480
4-chloro-N,N-diethyl-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazin-2-amine
CID 129286205
2-Chloro-4-ethoxy-6-(morpholin-4-yl)-1,3,5-triazine
CID 686749
2-Chloro-4-ethoxy-6-(piperidin-1-yl)-1,3,5-triazine
CID 706525
2-Chloro-4-diethylamino-6-methoxyamino-sym-triazine
CID 12584289
2-Chloro-4-di-n-propylamino-6-methoxy-sym-triazine
CID 62858664
4-chloro-6-methoxy-N,N-di(propan-2-yl)-1,3,5-triazin-2-amine
CID 162403036
4-chloro-N,N-diethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 55124473

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine (CID 62857212) is 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine is CCOc1nc(Cl)nc(N(CC)CC)n1.
What is the InChIKey of 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine?
The InChIKey is ZBXKBNAKAZFHSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15ClN4O/c1-4-14(5-2)8-11-7(10)12-9(13-8)15-6-3/h4-6H2,1-3H3.
What are the key properties of 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine?
4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine has a molecular weight of 230.70 g/mol, XLogP of 1.77, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-ethoxy-N,N-diethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 62857212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).