N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

C14H14ClN5S — CID 103334852

IUPACN-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(Nc3ccccc3Cl)nc(NN)nc2s1
InChIInChI=1S/C14H14ClN5S/c1-2-8-7-9-12(17-11-6-4-3-5-10(11)15)18-14(20-16)19-13(9)21-8/h3-7H,2,16H2,1H3,(H2,17,18,19,20)
InChIKeyJOSJBFAWAUMEJO-UHFFFAOYSA-N
MW319.82 g/mol
LogP3.94
Rot. Bonds4

About N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 103334852) has the molecular formula C14H14ClN5S and a molecular weight of 319.82 g/mol. Its IUPAC name is N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
PubChem CID103334852
Molecular FormulaC14H14ClN5S
Molecular Weight319.82 g/mol
Exact Mass319.07
IUPAC NameN-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(Nc3ccccc3Cl)nc(NN)nc2s1
InChIInChI=1S/C14H14ClN5S/c1-2-8-7-9-12(17-11-6-4-3-5-10(11)15)18-14(20-16)19-13(9)21-8/h3-7H,2,16H2,1H3,(H2,17,18,19,20)
InChIKeyJOSJBFAWAUMEJO-UHFFFAOYSA-N
XLogP3.94
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.82
LogP ≤ 53.94
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

N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
2-benzyl-N-(3-chloro-2-methylphenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 91964774
2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 103335072
N-(2,5-dichlorophenyl)-2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103334287
2-N-(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 103335521
2-benzyl-N-(2,5-dichlorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 91964768
4-chloro-6-ethyl-N-(2-fluorophenyl)thieno[2,3-d]pyrimidin-2-amine
CID 95528672
6-ethyl-N-(furan-3-ylmethyl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335794
6-ethyl-2-hydrazinyl-N,N-dipropylthieno[2,3-d]pyrimidin-4-amine
CID 103335029
N-(2-ethoxy-2-methylpropyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335867
[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336021
6-ethyl-2-hydrazinyl-N-methyl-N-(4-methylpentan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103333041

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine (CID 103334852) is N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine is CCc1cc2c(Nc3ccccc3Cl)nc(NN)nc2s1.
What is the InChIKey of N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is JOSJBFAWAUMEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN5S/c1-2-8-7-9-12(17-11-6-4-3-5-10(11)15)18-14(20-16)19-13(9)21-8/h3-7H,2,16H2,1H3,(H2,17,18,19,20).
What are the key properties of N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine?
N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 319.82 g/mol, XLogP of 3.94, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103334852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).