acridin-1-yl(pentyl)phosphane

C18H20NP — CID 174995472

IUPACacridin-1-yl(pentyl)phosphane
SMILESCCCCCPc1cccc2nc3ccccc3cc12
InChIInChI=1S/C18H20NP/c1-2-3-6-12-20-18-11-7-10-17-15(18)13-14-8-4-5-9-16(14)19-17/h4-5,7-11,13,20H,2-3,6,12H2,1H3
InChIKeyJGVWQCRVFRGYJD-UHFFFAOYSA-N
MW281.34 g/mol
LogP4.88
Rot. Bonds5

About acridin-1-yl(pentyl)phosphane

acridin-1-yl(pentyl)phosphane (PubChem CID 174995472) has the molecular formula C18H20NP and a molecular weight of 281.34 g/mol. Its IUPAC name is acridin-1-yl(pentyl)phosphane.

Molecular Properties

Compound Nameacridin-1-yl(pentyl)phosphane
PubChem CID174995472
Molecular FormulaC18H20NP
Molecular Weight281.34 g/mol
Exact Mass281.13
IUPAC Nameacridin-1-yl(pentyl)phosphane
SMILESCCCCCPc1cccc2nc3ccccc3cc12
InChIInChI=1S/C18H20NP/c1-2-3-6-12-20-18-11-7-10-17-15(18)13-14-8-4-5-9-16(14)19-17/h4-5,7-11,13,20H,2-3,6,12H2,1H3
InChIKeyJGVWQCRVFRGYJD-UHFFFAOYSA-N
XLogP4.88
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

acridine;heptane
CID 158562494
1-octadecylacridine
CID 87175858
1-hexadecylacridine;hydrochloride
CID 172754650
1-decoxyacridine
CID 159660851
2-acridin-1-yl-1-heptylacridine
CID 164897649
3-hexylacridine
CID 21394642
1-acridin-1-ylbutan-1-one
CID 174652191
N-ethyl-N-propylacridin-1-amine
CID 21107283
1-methylacridine;hydrochloride
CID 175333750
2-acridin-1-yl-1-aminohexan-2-ol
CID 22142034
acridine;9-propylacridine
CID 146450775
(2-pentylphosphanylphenyl)methanamine
CID 151860169

Frequently Asked Questions

What is the IUPAC name of acridin-1-yl(pentyl)phosphane?
The IUPAC name of acridin-1-yl(pentyl)phosphane (CID 174995472) is acridin-1-yl(pentyl)phosphane.
What is the SMILES notation for acridin-1-yl(pentyl)phosphane?
The canonical SMILES for acridin-1-yl(pentyl)phosphane is CCCCCPc1cccc2nc3ccccc3cc12.
What is the InChIKey of acridin-1-yl(pentyl)phosphane?
The InChIKey is JGVWQCRVFRGYJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20NP/c1-2-3-6-12-20-18-11-7-10-17-15(18)13-14-8-4-5-9-16(14)19-17/h4-5,7-11,13,20H,2-3,6,12H2,1H3.
What are the key properties of acridin-1-yl(pentyl)phosphane?
acridin-1-yl(pentyl)phosphane has a molecular weight of 281.34 g/mol, XLogP of 4.88, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acridin-1-yl(pentyl)phosphane is sourced from PubChem (CID 174995472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).