CID 10433026

C15H12ClN2 — CID 10433026

IUPAC—
SMILESClc1ccc2c(NC[C]3[CH][CH][CH][CH]3)ccnc2c1
InChIInChI=1S/C15H12ClN2/c16-12-5-6-13-14(7-8-17-15(13)9-12)18-10-11-3-1-2-4-11/h1-9H,10H2,(H,17,18)
InChIKeyORMJOSSTVLQKEN-UHFFFAOYSA-N
MW255.73 g/mol
LogP3.71
Rot. Bonds3

About CID 10433026

CID 10433026 (PubChem CID 10433026) has the molecular formula C15H12ClN2 and a molecular weight of 255.73 g/mol.

Molecular Properties

Compound NameCID 10433026
PubChem CID10433026
Molecular FormulaC15H12ClN2
Molecular Weight255.73 g/mol
Exact Mass255.07
IUPAC Name—
SMILESClc1ccc2c(NC[C]3[CH][CH][CH][CH]3)ccnc2c1
InChIInChI=1S/C15H12ClN2/c16-12-5-6-13-14(7-8-17-15(13)9-12)18-10-11-3-1-2-4-11/h1-9H,10H2,(H,17,18)
InChIKeyORMJOSSTVLQKEN-UHFFFAOYSA-N
XLogP3.71
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.73
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 10433026?
The IUPAC name of CID 10433026 (CID 10433026) is not available.
What is the SMILES notation for CID 10433026?
The canonical SMILES for CID 10433026 is Clc1ccc2c(NC[C]3[CH][CH][CH][CH]3)ccnc2c1.
What is the InChIKey of CID 10433026?
The InChIKey is ORMJOSSTVLQKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN2/c16-12-5-6-13-14(7-8-17-15(13)9-12)18-10-11-3-1-2-4-11/h1-9H,10H2,(H,17,18).
What are the key properties of CID 10433026?
CID 10433026 has a molecular weight of 255.73 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10433026 is sourced from PubChem (CID 10433026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).