2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine

C15H23N5S — CID 133418780

IUPAC2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
SMILESCCC(Nc1nc(C(C)C)nc(N(C)C)n1)c1cccs1
InChIInChI=1S/C15H23N5S/c1-6-11(12-8-7-9-21-12)16-14-17-13(10(2)3)18-15(19-14)20(4)5/h7-11H,6H2,1-5H3,(H,16,17,18,19)
InChIKeyRJGPHDPHTXQQQJ-UHFFFAOYSA-N
MW305.45 g/mol
LogP3.69
Rot. Bonds6

About 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine

2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine (PubChem CID 133418780) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
PubChem CID133418780
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
SMILESCCC(Nc1nc(C(C)C)nc(N(C)C)n1)c1cccs1
InChIInChI=1S/C15H23N5S/c1-6-11(12-8-7-9-21-12)16-14-17-13(10(2)3)18-15(19-14)20(4)5/h7-11H,6H2,1-5H3,(H,16,17,18,19)
InChIKeyRJGPHDPHTXQQQJ-UHFFFAOYSA-N
XLogP3.69
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

2-N,2-N-dimethyl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine
CID 80807202
6-chloro-2-N,2-N-dimethyl-4-N-(1-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 62863344
6-(1,2,2,2-tetrafluoroethyl)-2-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
CID 59874342
4-hydrazinyl-6-propan-2-yloxy-N-(1-thiophen-2-ylpropyl)-1,3,5-triazin-2-amine
CID 80901589
3-[[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]amino]-3-(4-methoxyphenyl)propan-1-ol
CID 126787453
4-ethoxy-6-methyl-N-(1-thiophen-2-ylpropyl)pyrimidin-2-amine
CID 112637254
4-N-[1-(1-benzofuran-2-yl)ethyl]-2-N,2-N-dimethyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133431839
6-(2-fluoropropan-2-yl)-2-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
CID 10859400
3-propan-2-yl-N-(1-thiophen-2-ylbutyl)-1,2,4-thiadiazol-5-amine
CID 65276944
3-N,3-N,4-trimethyl-1-N-(1-thiophen-2-ylpropyl)benzene-1,3-diamine
CID 115377070
2-cyclopropyl-N-(1-thiophen-2-ylpropyl)pyrimidin-4-amine
CID 133336493
5-bromo-4-methoxy-N-(1-thiophen-2-ylpropyl)pyrimidin-2-amine
CID 102809527

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine (CID 133418780) is 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine is CCC(Nc1nc(C(C)C)nc(N(C)C)n1)c1cccs1.
What is the InChIKey of 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is RJGPHDPHTXQQQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-6-11(12-8-7-9-21-12)16-14-17-13(10(2)3)18-15(19-14)20(4)5/h7-11H,6H2,1-5H3,(H,16,17,18,19).
What are the key properties of 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine?
2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 305.45 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-6-propan-2-yl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 133418780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).