2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine

C14H21N5S — CID 103333224

IUPAC2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(NC3(C)CCCCC3)nc(NN)nc2s1
InChIInChI=1S/C14H21N5S/c1-9-8-10-11(16-13(19-15)17-12(10)20-9)18-14(2)6-4-3-5-7-14/h8H,3-7,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyGPBXBTMHDSDXCT-UHFFFAOYSA-N
MW291.42 g/mol
LogP3.42
Rot. Bonds3

About 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine

2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 103333224) has the molecular formula C14H21N5S and a molecular weight of 291.42 g/mol. Its IUPAC name is 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID103333224
Molecular FormulaC14H21N5S
Molecular Weight291.42 g/mol
Exact Mass291.15
IUPAC Name2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(NC3(C)CCCCC3)nc(NN)nc2s1
InChIInChI=1S/C14H21N5S/c1-9-8-10-11(16-13(19-15)17-12(10)20-9)18-14(2)6-4-3-5-7-14/h8H,3-7,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyGPBXBTMHDSDXCT-UHFFFAOYSA-N
XLogP3.42
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 53.42
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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Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine (CID 103333224) is 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine is Cc1cc2c(NC3(C)CCCCC3)nc(NN)nc2s1.
What is the InChIKey of 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is GPBXBTMHDSDXCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5S/c1-9-8-10-11(16-13(19-15)17-12(10)20-9)18-14(2)6-4-3-5-7-14/h8H,3-7,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 291.42 g/mol, XLogP of 3.42, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-6-methyl-N-(1-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103333224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).