2-azido-10-methylacridin-10-ium-9-amine

C14H12N5+ — CID 3036763

IUPAC2-azido-10-methylacridin-10-ium-9-amine
SMILESC[n+]1c2ccccc2c(N)c2cc(N=[N+]=[N-])ccc21
InChIInChI=1S/C14H11N5/c1-19-12-5-3-2-4-10(12)14(15)11-8-9(17-18-16)6-7-13(11)19/h2-8,15H,1H3/p+1
InChIKeyCJZPBUUCHOBBHW-UHFFFAOYSA-O
MW250.29 g/mol
LogP3.34
Rot. Bonds1

About 2-azido-10-methylacridin-10-ium-9-amine

2-azido-10-methylacridin-10-ium-9-amine (PubChem CID 3036763) has the molecular formula C14H12N5+ and a molecular weight of 250.29 g/mol. Its IUPAC name is 2-azido-10-methylacridin-10-ium-9-amine.

Molecular Properties

Compound Name2-azido-10-methylacridin-10-ium-9-amine
PubChem CID3036763
Molecular FormulaC14H12N5+
Molecular Weight250.29 g/mol
Exact Mass250.11
IUPAC Name2-azido-10-methylacridin-10-ium-9-amine
SMILESC[n+]1c2ccccc2c(N)c2cc(N=[N+]=[N-])ccc21
InChIInChI=1S/C14H11N5/c1-19-12-5-3-2-4-10(12)14(15)11-8-9(17-18-16)6-7-13(11)19/h2-8,15H,1H3/p+1
InChIKeyCJZPBUUCHOBBHW-UHFFFAOYSA-O
XLogP3.34
TPSA78.66 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.29
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'amino_acridine_A(46)', 'substructure': 'N/A'}, {'alert_name': 'het_pyridiniums_A(39)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 2-azido-10-methylacridin-10-ium-9-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-azidonaphthalen-1-amine
CID 21162853
N-(9-amino-10-methylacridin-10-ium-2-yl)acetamide;hydrogen sulfate
CID 173224592
4-azido-2-methyl-1-phenylbenzene
CID 151430322
5-methyl-10H-indolo[3,2-b]quinolin-5-ium-11-amine
CID 67597321
2-ethyl-1,3-dimethylquinolin-1-ium-4-amine iodide
CID 44655304
(4-azidophenyl)-(2-methyl-1H-indol-3-yl)methanone
CID 175114331
5-azido-2-methylphenol
CID 90382117
1-(4-azidophenyl)-2-phenylethane-1,2-dione
CID 89499580
(3-azidophenyl)methanamine
CID 21438660
1-(4-azidophenyl)-2-phenylethane-1,2-dione;1-phenylethanone
CID 89499579
9-(4-azidophenyl)acridine
CID 15340007
1-(5-azido-2-methylphenyl)pyrrole
CID 151611091

Frequently Asked Questions

What is the IUPAC name of 2-azido-10-methylacridin-10-ium-9-amine?
The IUPAC name of 2-azido-10-methylacridin-10-ium-9-amine (CID 3036763) is 2-azido-10-methylacridin-10-ium-9-amine.
What is the SMILES notation for 2-azido-10-methylacridin-10-ium-9-amine?
The canonical SMILES for 2-azido-10-methylacridin-10-ium-9-amine is C[n+]1c2ccccc2c(N)c2cc(N=[N+]=[N-])ccc21.
What is the InChIKey of 2-azido-10-methylacridin-10-ium-9-amine?
The InChIKey is CJZPBUUCHOBBHW-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H11N5/c1-19-12-5-3-2-4-10(12)14(15)11-8-9(17-18-16)6-7-13(11)19/h2-8,15H,1H3/p+1.
What are the key properties of 2-azido-10-methylacridin-10-ium-9-amine?
2-azido-10-methylacridin-10-ium-9-amine has a molecular weight of 250.29 g/mol, XLogP of 3.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azido-10-methylacridin-10-ium-9-amine is sourced from PubChem (CID 3036763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).