2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine

C15H21N5O — CID 80795763

IUPAC2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(OC(C)C)nc(N(C)c2cccc(C)c2)n1
InChIInChI=1S/C15H21N5O/c1-10(2)21-15-18-13(16-4)17-14(19-15)20(5)12-8-6-7-11(3)9-12/h6-10H,1-5H3,(H,16,17,18,19)
InChIKeyIARQPYHEQQTWKZ-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.78
Rot. Bonds5

About 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine

2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine (PubChem CID 80795763) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
PubChem CID80795763
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(OC(C)C)nc(N(C)c2cccc(C)c2)n1
InChIInChI=1S/C15H21N5O/c1-10(2)21-15-18-13(16-4)17-14(19-15)20(5)12-8-6-7-11(3)9-12/h6-10H,1-5H3,(H,16,17,18,19)
InChIKeyIARQPYHEQQTWKZ-UHFFFAOYSA-N
XLogP2.78
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

2-N-(3-methoxyphenyl)-2-N,4-N,4-N,6-N-tetramethyl-1,3,5-triazine-2,4,6-triamine
CID 80796248
2-N-cyclohexyl-2-N,4-N-dimethyl-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80762337
4,6-dichloro-N-methyl-N-(3-methylphenyl)-1,3,5-triazin-2-amine
CID 55124750
2-N-(2-fluoro-4-methylphenyl)-4-N-methyl-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80729258
6-chloro-2-N-(3-methoxyphenyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80817157
2-N,4-N-dimethyl-6-propan-2-yloxy-2-N-(2-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80836580
4-(3-fluoro-2-methylphenyl)-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 115503015
2-N,4-N-dimethyl-6-propan-2-yloxy-2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80781042
4-(2-fluoro-4-methoxyphenyl)-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 115505268
N,N-dimethyl-2-[methyl-[4-(methylamino)-6-propan-2-yloxy-1,3,5-triazin-2-yl]amino]acetamide
CID 80780568
3-N-(4,6-dimethylpyrimidin-2-yl)-1-N,3-N-dimethylbenzene-1,3-diamine
CID 117044722
2-N,4-N,4-N,6-N-tetramethyl-2-N-(4-methylphenyl)-1,3,5-triazine-2,4,6-triamine
CID 80818422

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine (CID 80795763) is 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine is CNc1nc(OC(C)C)nc(N(C)c2cccc(C)c2)n1.
What is the InChIKey of 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine?
The InChIKey is IARQPYHEQQTWKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-10(2)21-15-18-13(16-4)17-14(19-15)20(5)12-8-6-7-11(3)9-12/h6-10H,1-5H3,(H,16,17,18,19).
What are the key properties of 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine?
2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine has a molecular weight of 287.37 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dimethyl-2-N-(3-methylphenyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80795763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).