N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine

C11H15N5S — CID 103335783

IUPACN-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCN(c1nc(NN)nc2sccc12)C1CCC1
InChIInChI=1S/C11H15N5S/c1-16(7-3-2-4-7)9-8-5-6-17-10(8)14-11(13-9)15-12/h5-7H,2-4,12H2,1H3,(H,13,14,15)
InChIKeyIAXQKMBEBWFKOR-UHFFFAOYSA-N
MW249.34 g/mol
LogP1.97
Rot. Bonds3

About N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine

N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 103335783) has the molecular formula C11H15N5S and a molecular weight of 249.34 g/mol. Its IUPAC name is N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID103335783
Molecular FormulaC11H15N5S
Molecular Weight249.34 g/mol
Exact Mass249.10
IUPAC NameN-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCN(c1nc(NN)nc2sccc12)C1CCC1
InChIInChI=1S/C11H15N5S/c1-16(7-3-2-4-7)9-8-5-6-17-10(8)14-11(13-9)15-12/h5-7H,2-4,12H2,1H3,(H,13,14,15)
InChIKeyIAXQKMBEBWFKOR-UHFFFAOYSA-N
XLogP1.97
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 51.97
H-Bond Donors ≤ 52
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

N-(4,4-dimethylcyclohexyl)-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103334638
N-(4-ethylcyclohexyl)-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103332677
N-cyclopropyl-N-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335410
2-N,4-N-dimethyl-4-N-(3-methylcyclohexyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325764
2-[cyclopentyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 103333025
N-cyclohexyl-2-hydrazinyl-N,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103334925
2-N-ethyl-4-N-methyl-4-N-(oxan-4-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325225
2-[cyclopropyl-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 103333014
2-hydrazinyl-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 103334518
N-cyclohexyl-6-ethyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103334924
4-N-methyl-4-N-(oxan-4-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325226
N-ethyl-2-hydrazinyl-N-phenylthieno[2,3-d]pyrimidin-4-amine
CID 103333918

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine (CID 103335783) is N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine is CN(c1nc(NN)nc2sccc12)C1CCC1.
What is the InChIKey of N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is IAXQKMBEBWFKOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5S/c1-16(7-3-2-4-7)9-8-5-6-17-10(8)14-11(13-9)15-12/h5-7H,2-4,12H2,1H3,(H,13,14,15).
What are the key properties of N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine?
N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 249.34 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-hydrazinyl-N-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103335783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).