2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol

C13H19N5OS — CID 103333417

IUPAC2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol
SMILESCc1cc2c(NC3CCCCC3O)nc(NN)nc2s1
InChIInChI=1S/C13H19N5OS/c1-7-6-8-11(15-9-4-2-3-5-10(9)19)16-13(18-14)17-12(8)20-7/h6,9-10,19H,2-5,14H2,1H3,(H2,15,16,17,18)
InChIKeyRJQKSHMNUZXGHV-UHFFFAOYSA-N
MW293.40 g/mol
LogP2.00
Rot. Bonds3

About 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol

2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol (PubChem CID 103333417) has the molecular formula C13H19N5OS and a molecular weight of 293.40 g/mol. Its IUPAC name is 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol
PubChem CID103333417
Molecular FormulaC13H19N5OS
Molecular Weight293.40 g/mol
Exact Mass293.13
IUPAC Name2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol
SMILESCc1cc2c(NC3CCCCC3O)nc(NN)nc2s1
InChIInChI=1S/C13H19N5OS/c1-7-6-8-11(15-9-4-2-3-5-10(9)19)16-13(18-14)17-12(8)20-7/h6,9-10,19H,2-5,14H2,1H3,(H2,15,16,17,18)
InChIKeyRJQKSHMNUZXGHV-UHFFFAOYSA-N
XLogP2.00
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.40
LogP ≤ 52.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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

2-hydrazinyl-6-methyl-N-(2-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 103335312
3-[[6-methyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]cyclobutan-1-ol
CID 103328691
N-cyclohexyl-2-hydrazinyl-N,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103334925
2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 103333224
2-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80919191
4-N-cyclopropyl-2-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324095
1-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]propan-2-ol
CID 103332256
N-cyclopentyl-N-ethyl-2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103332300
1-(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-2-carboxamide
CID 103332954
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103332422
[4-(2-ethylcyclohexyl)oxy-6-methylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336070
3-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methylpropane-1,2-diol
CID 103334447

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol (CID 103333417) is 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol is Cc1cc2c(NC3CCCCC3O)nc(NN)nc2s1.
What is the InChIKey of 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol?
The InChIKey is RJQKSHMNUZXGHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5OS/c1-7-6-8-11(15-9-4-2-3-5-10(9)19)16-13(18-14)17-12(8)20-7/h6,9-10,19H,2-5,14H2,1H3,(H2,15,16,17,18).
What are the key properties of 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol?
2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol has a molecular weight of 293.40 g/mol, XLogP of 2.00, 3 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 103333417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).