[5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine

C19H16ClN5O — CID 10761360

IUPAC[5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCOc1ccc(-n2cc(-c3ccc(Cl)cc3)c3c(NN)ncnc32)cc1
InChIInChI=1S/C19H16ClN5O/c1-26-15-8-6-14(7-9-15)25-10-16(12-2-4-13(20)5-3-12)17-18(24-21)22-11-23-19(17)25/h2-11H,21H2,1H3,(H,22,23,24)
InChIKeySNJZKAQRLKYLQL-UHFFFAOYSA-N
MW365.82 g/mol
LogP4.04
Rot. Bonds4

About [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine

[5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 10761360) has the molecular formula C19H16ClN5O and a molecular weight of 365.82 g/mol. Its IUPAC name is [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID10761360
Molecular FormulaC19H16ClN5O
Molecular Weight365.82 g/mol
Exact Mass365.10
IUPAC Name[5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCOc1ccc(-n2cc(-c3ccc(Cl)cc3)c3c(NN)ncnc32)cc1
InChIInChI=1S/C19H16ClN5O/c1-26-15-8-6-14(7-9-15)25-10-16(12-2-4-13(20)5-3-12)17-18(24-21)22-11-23-19(17)25/h2-11H,21H2,1H3,(H,22,23,24)
InChIKeySNJZKAQRLKYLQL-UHFFFAOYSA-N
XLogP4.04
TPSA77.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 54.04
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'}

Analyze [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine (CID 10761360) is [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine is COc1ccc(-n2cc(-c3ccc(Cl)cc3)c3c(NN)ncnc32)cc1.
What is the InChIKey of [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is SNJZKAQRLKYLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN5O/c1-26-15-8-6-14(7-9-15)25-10-16(12-2-4-13(20)5-3-12)17-18(24-21)22-11-23-19(17)25/h2-11H,21H2,1H3,(H,22,23,24).
What are the key properties of [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine?
[5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 365.82 g/mol, XLogP of 4.04, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-chlorophenyl)-7-(4-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 10761360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).