4-propylacridine

C16H15N — CID 609894

IUPAC4-propylacridine
SMILESCCCc1cccc2cc3ccccc3nc12
InChIInChI=1S/C16H15N/c1-2-6-12-8-5-9-14-11-13-7-3-4-10-15(13)17-16(12)14/h3-5,7-11H,2,6H2,1H3
InChIKeyJSQXSKCAAQQVGQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP4.34
Rot. Bonds2

About 4-propylacridine

4-propylacridine (PubChem CID 609894) has the molecular formula C16H15N and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-propylacridine.

Molecular Properties

Compound Name4-propylacridine
PubChem CID609894
Molecular FormulaC16H15N
Molecular Weight221.30 g/mol
Exact Mass221.12
IUPAC Name4-propylacridine
SMILESCCCc1cccc2cc3ccccc3nc12
InChIInChI=1S/C16H15N/c1-2-6-12-8-5-9-14-11-13-7-3-4-10-15(13)17-16(12)14/h3-5,7-11H,2,6H2,1H3
InChIKeyJSQXSKCAAQQVGQ-UHFFFAOYSA-N
XLogP4.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-methyl-3,8-dipropylquinolin-2-amine
CID 55223741
3-methyl-8-propylquinolin-2-amine
CID 63232824
N-ethyl-3-propylquinolin-2-amine
CID 63232591
2-tert-butyl-3-propylquinoline
CID 102039878
1-octadecylacridine
CID 87175858
acridine;9-propylacridine
CID 146450775
1-hexadecylacridine;hydrochloride
CID 172754650
acridine;heptane
CID 158562494
4-propan-2-ylacridine
CID 87209750
N-methyl-3-propan-2-yl-8-propylquinolin-2-amine
CID 63524556
acridin-4-ylboronic acid
CID 158530162
1-heptylphenazine;hydrochloride
CID 175352325

Frequently Asked Questions

What is the IUPAC name of 4-propylacridine?
The IUPAC name of 4-propylacridine (CID 609894) is 4-propylacridine.
What is the SMILES notation for 4-propylacridine?
The canonical SMILES for 4-propylacridine is CCCc1cccc2cc3ccccc3nc12.
What is the InChIKey of 4-propylacridine?
The InChIKey is JSQXSKCAAQQVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N/c1-2-6-12-8-5-9-14-11-13-7-3-4-10-15(13)17-16(12)14/h3-5,7-11H,2,6H2,1H3.
What are the key properties of 4-propylacridine?
4-propylacridine has a molecular weight of 221.30 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propylacridine is sourced from PubChem (CID 609894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).