4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine

C10H14N6OS — CID 80943741

IUPAC4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NN)nc(NCCc2cccs2)n1
InChIInChI=1S/C10H14N6OS/c1-17-10-14-8(13-9(15-10)16-11)12-5-4-7-3-2-6-18-7/h2-3,6H,4-5,11H2,1H3,(H2,12,13,14,15,16)
InChIKeyCXFJILIPLRDWRA-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.88
Rot. Bonds6

About 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine

4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine (PubChem CID 80943741) has the molecular formula C10H14N6OS and a molecular weight of 266.33 g/mol. Its IUPAC name is 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine
PubChem CID80943741
Molecular FormulaC10H14N6OS
Molecular Weight266.33 g/mol
Exact Mass266.09
IUPAC Name4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NN)nc(NCCc2cccs2)n1
InChIInChI=1S/C10H14N6OS/c1-17-10-14-8(13-9(15-10)16-11)12-5-4-7-3-2-6-18-7/h2-3,6H,4-5,11H2,1H3,(H2,12,13,14,15,16)
InChIKeyCXFJILIPLRDWRA-UHFFFAOYSA-N
XLogP0.88
TPSA97.98 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-hydrazinyl-6-propoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine
CID 80943280
6-methoxy-4-N-methyl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80773310
6-methoxy-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80773315
N-ethyl-4-methoxy-6-(2-thiophen-2-ylethoxy)-1,3,5-triazin-2-amine
CID 80873852
4-hydrazinyl-6-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1,3,5-triazin-2-amine
CID 106412556
4-hydrazinyl-6-methoxy-N-(1-thiophen-2-ylbutyl)-1,3,5-triazin-2-amine
CID 80897742
N-(furan-2-ylmethyl)-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
CID 80932085
4-hydrazinyl-6-methoxy-N-(3-methylsulfonylpropyl)-1,3,5-triazin-2-amine
CID 80903842
N-[2-(5-chlorothiophen-2-yl)ethyl]-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 103702670
4-N-(4-methoxyphenyl)-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine
CID 19149188
4-hydrazinyl-6-methoxy-N-[(6-methyl-2-pyridinyl)methyl]-1,3,5-triazin-2-amine
CID 80908132
4,6-dimethoxy-N-(1-thiophen-2-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 63291908

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine (CID 80943741) is 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine is COc1nc(NN)nc(NCCc2cccs2)n1.
What is the InChIKey of 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine?
The InChIKey is CXFJILIPLRDWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6OS/c1-17-10-14-8(13-9(15-10)16-11)12-5-4-7-3-2-6-18-7/h2-3,6H,4-5,11H2,1H3,(H2,12,13,14,15,16).
What are the key properties of 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine?
4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine has a molecular weight of 266.33 g/mol, XLogP of 0.88, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-6-methoxy-N-(2-thiophen-2-ylethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80943741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).