N-(2-piperidin-1-ylethyl)acridin-9-amine

C20H23N3 — CID 4976664

IUPACN-(2-piperidin-1-ylethyl)acridin-9-amine
SMILESc1ccc2c(NCCN3CCCCC3)c3ccccc3nc2c1
InChIInChI=1S/C20H23N3/c1-6-13-23(14-7-1)15-12-21-20-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)20/h2-5,8-11H,1,6-7,12-15H2,(H,21,22)
InChIKeyLTWJTTXCABZCDC-UHFFFAOYSA-N
MW305.43 g/mol
LogP4.29
Rot. Bonds4

About N-(2-piperidin-1-ylethyl)acridin-9-amine

N-(2-piperidin-1-ylethyl)acridin-9-amine (PubChem CID 4976664) has the molecular formula C20H23N3 and a molecular weight of 305.43 g/mol. Its IUPAC name is N-(2-piperidin-1-ylethyl)acridin-9-amine.

Molecular Properties

Compound NameN-(2-piperidin-1-ylethyl)acridin-9-amine
PubChem CID4976664
Molecular FormulaC20H23N3
Molecular Weight305.43 g/mol
Exact Mass305.19
IUPAC NameN-(2-piperidin-1-ylethyl)acridin-9-amine
SMILESc1ccc2c(NCCN3CCCCC3)c3ccccc3nc2c1
InChIInChI=1S/C20H23N3/c1-6-13-23(14-7-1)15-12-21-20-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)20/h2-5,8-11H,1,6-7,12-15H2,(H,21,22)
InChIKeyLTWJTTXCABZCDC-UHFFFAOYSA-N
XLogP4.29
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'amino_acridine_A(46)', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylethyl)acridin-9-amine?
The IUPAC name of N-(2-piperidin-1-ylethyl)acridin-9-amine (CID 4976664) is N-(2-piperidin-1-ylethyl)acridin-9-amine.
What is the SMILES notation for N-(2-piperidin-1-ylethyl)acridin-9-amine?
The canonical SMILES for N-(2-piperidin-1-ylethyl)acridin-9-amine is c1ccc2c(NCCN3CCCCC3)c3ccccc3nc2c1.
What is the InChIKey of N-(2-piperidin-1-ylethyl)acridin-9-amine?
The InChIKey is LTWJTTXCABZCDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3/c1-6-13-23(14-7-1)15-12-21-20-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)20/h2-5,8-11H,1,6-7,12-15H2,(H,21,22).
What are the key properties of N-(2-piperidin-1-ylethyl)acridin-9-amine?
N-(2-piperidin-1-ylethyl)acridin-9-amine has a molecular weight of 305.43 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylethyl)acridin-9-amine is sourced from PubChem (CID 4976664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).