6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine

C10H13N5S — CID 80897852

IUPAC6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
SMILESNNc1cc(NCCc2ccsc2)ncn1
InChIInChI=1S/C10H13N5S/c11-15-10-5-9(13-7-14-10)12-3-1-8-2-4-16-6-8/h2,4-7H,1,3,11H2,(H2,12,13,14,15)
InChIKeyZYQLUKWDPYPBBH-UHFFFAOYSA-N
MW235.32 g/mol
LogP1.48
Rot. Bonds5

About 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine

6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine (PubChem CID 80897852) has the molecular formula C10H13N5S and a molecular weight of 235.32 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
PubChem CID80897852
Molecular FormulaC10H13N5S
Molecular Weight235.32 g/mol
Exact Mass235.09
IUPAC Name6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
SMILESNNc1cc(NCCc2ccsc2)ncn1
InChIInChI=1S/C10H13N5S/c11-15-10-5-9(13-7-14-10)12-3-1-8-2-4-16-6-8/h2,4-7H,1,3,11H2,(H2,12,13,14,15)
InChIKeyZYQLUKWDPYPBBH-UHFFFAOYSA-N
XLogP1.48
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.32
LogP ≤ 51.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

6-methylsulfanyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
CID 106972720
6-propan-2-yloxy-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
CID 66329575
N-[2-(4-chlorophenyl)ethyl]-6-hydrazinylpyrimidin-4-amine
CID 80899019
6-N,2-diethyl-4-N-(2-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80935379
methyl 5-amino-2-(2-thiophen-3-ylethylamino)pyridine-4-carboxylate
CID 114090203
N-cyclopropyl-6-hydrazinyl-N-(thiophen-3-ylmethyl)pyrimidin-4-amine
CID 80896481
2-propan-2-yl-6-N-propyl-4-N-(2-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80961771
2-phenyl-4-N-(2-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 115915460
6-N-ethyl-4-N-(2-thiophen-3-ylethyl)-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106771223
6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
CID 63962803
4-bromo-2-N-(2-thiophen-3-ylethyl)benzene-1,2-diamine
CID 65343541
6-propoxy-2-N-(2-thiophen-3-ylethyl)pyridine-2,5-diamine
CID 61474843

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine (CID 80897852) is 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine is NNc1cc(NCCc2ccsc2)ncn1.
What is the InChIKey of 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine?
The InChIKey is ZYQLUKWDPYPBBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5S/c11-15-10-5-9(13-7-14-10)12-3-1-8-2-4-16-6-8/h2,4-7H,1,3,11H2,(H2,12,13,14,15).
What are the key properties of 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine?
6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine has a molecular weight of 235.32 g/mol, XLogP of 1.48, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 80897852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).