10-propyl-9H-acridine

C16H17N — CID 71122947

IUPAC10-propyl-9H-acridine
SMILESCCCN1c2ccccc2Cc2ccccc21
InChIInChI=1S/C16H17N/c1-2-11-17-15-9-5-3-7-13(15)12-14-8-4-6-10-16(14)17/h3-10H,2,11-12H2,1H3
InChIKeyJJXBNMYPLOCBSR-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.14
Rot. Bonds2

About 10-propyl-9H-acridine

10-propyl-9H-acridine (PubChem CID 71122947) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 10-propyl-9H-acridine.

Molecular Properties

Compound Name10-propyl-9H-acridine
PubChem CID71122947
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name10-propyl-9H-acridine
SMILESCCCN1c2ccccc2Cc2ccccc21
InChIInChI=1S/C16H17N/c1-2-11-17-15-9-5-3-7-13(15)12-14-8-4-6-10-16(14)17/h3-10H,2,11-12H2,1H3
InChIKeyJJXBNMYPLOCBSR-UHFFFAOYSA-N
XLogP4.14
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10-propyl-9H-acridine?
The IUPAC name of 10-propyl-9H-acridine (CID 71122947) is 10-propyl-9H-acridine.
What is the SMILES notation for 10-propyl-9H-acridine?
The canonical SMILES for 10-propyl-9H-acridine is CCCN1c2ccccc2Cc2ccccc21.
What is the InChIKey of 10-propyl-9H-acridine?
The InChIKey is JJXBNMYPLOCBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-2-11-17-15-9-5-3-7-13(15)12-14-8-4-6-10-16(14)17/h3-10H,2,11-12H2,1H3.
What are the key properties of 10-propyl-9H-acridine?
10-propyl-9H-acridine has a molecular weight of 223.32 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-propyl-9H-acridine is sourced from PubChem (CID 71122947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).