1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine

C17H18N2 — CID 3044165

IUPAC1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine
SMILESCC(C)/N=C/N1c2ccccc2Cc2ccccc21
InChIInChI=1S/C17H18N2/c1-13(2)18-12-19-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)19/h3-10,12-13H,11H2,1-2H3/b18-12+
InChIKeyZMUYVKRCVIBJSM-LDADJPATSA-N
MW250.34 g/mol
LogP4.17
Rot. Bonds2

About 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine

1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine (PubChem CID 3044165) has the molecular formula C17H18N2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine.

Molecular Properties

Compound Name1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine
PubChem CID3044165
Molecular FormulaC17H18N2
Molecular Weight250.34 g/mol
Exact Mass250.15
IUPAC Name1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine
SMILESCC(C)/N=C/N1c2ccccc2Cc2ccccc21
InChIInChI=1S/C17H18N2/c1-13(2)18-12-19-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)19/h3-10,12-13H,11H2,1-2H3/b18-12+
InChIKeyZMUYVKRCVIBJSM-LDADJPATSA-N
XLogP4.17
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine?
The IUPAC name of 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine (CID 3044165) is 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine.
What is the SMILES notation for 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine?
The canonical SMILES for 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine is CC(C)/N=C/N1c2ccccc2Cc2ccccc21.
What is the InChIKey of 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine?
The InChIKey is ZMUYVKRCVIBJSM-LDADJPATSA-N. The full InChI is InChI=1S/C17H18N2/c1-13(2)18-12-19-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)19/h3-10,12-13H,11H2,1-2H3/b18-12+.
What are the key properties of 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine?
1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine has a molecular weight of 250.34 g/mol, XLogP of 4.17, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-acridin-10-yl)-N-propan-2-ylmethanimine is sourced from PubChem (CID 3044165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).