4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine

C15H17ClN4O — CID 62858726

IUPAC4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine
SMILESCCOc1nc(Cl)nc(NC2CCc3ccccc3C2)n1
InChIInChI=1S/C15H17ClN4O/c1-2-21-15-19-13(16)18-14(20-15)17-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,12H,2,7-9H2,1H3,(H,17,18,19,20)
InChIKeyWALHSWPTOWYHNW-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.89
Rot. Bonds4

About 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine

4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine (PubChem CID 62858726) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine
PubChem CID62858726
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine
SMILESCCOc1nc(Cl)nc(NC2CCc3ccccc3C2)n1
InChIInChI=1S/C15H17ClN4O/c1-2-21-15-19-13(16)18-14(20-15)17-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,12H,2,7-9H2,1H3,(H,17,18,19,20)
InChIKeyWALHSWPTOWYHNW-UHFFFAOYSA-N
XLogP2.89
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-chloro-N-(3,5-dimethylcyclohexyl)-6-ethoxy-1,3,5-triazin-2-amine
CID 64732550
4-chloro-N-(1,1-dioxothian-4-yl)-6-ethoxy-1,3,5-triazin-2-amine
CID 62857056
4-chloro-N-(2,2-dimethyloxan-4-yl)-6-ethoxy-1,3,5-triazin-2-amine
CID 83028910
4-chloro-N-cyclopentyl-6-propoxy-1,3,5-triazin-2-amine
CID 55124107
4-chloro-6-ethoxy-N-(2-fluorophenyl)-1,3,5-triazin-2-amine
CID 62858365
4-N-(4-chlorophenyl)-2-N-cyclopentyl-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 686003
2-(4-chloro-6-ethoxy-1,3,5-triazin-2-yl)-3,4-dihydro-1H-isoquinoline
CID 62859558
6-ethoxy-2-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3,5-triazine-2,4-diamine
CID 80797018
2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine
CID 80797857
4-methyl-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyrimidine-5-carboxylic acid
CID 83178304
2-N-(2,3-dihydro-1H-inden-2-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 107855436
4-chloro-6-ethoxy-N-(4-methylphenyl)-1,3,5-triazin-2-amine
CID 62859043

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine (CID 62858726) is 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine is CCOc1nc(Cl)nc(NC2CCc3ccccc3C2)n1.
What is the InChIKey of 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is WALHSWPTOWYHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-2-21-15-19-13(16)18-14(20-15)17-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,12H,2,7-9H2,1H3,(H,17,18,19,20).
What are the key properties of 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine?
4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 304.78 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 62858726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).