7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine

C20H19ClN2 — CID 20858370

IUPAC7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine
SMILESCc1ccccc1Nc1c2c(nc3ccc(Cl)cc13)CCCC2
InChIInChI=1S/C20H19ClN2/c1-13-6-2-4-8-17(13)23-20-15-7-3-5-9-18(15)22-19-11-10-14(21)12-16(19)20/h2,4,6,8,10-12H,3,5,7,9H2,1H3,(H,22,23)
InChIKeyNBZRXAJOTZHTLL-UHFFFAOYSA-N
MW322.84 g/mol
LogP5.82
Rot. Bonds2

About 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine

7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 20858370) has the molecular formula C20H19ClN2 and a molecular weight of 322.84 g/mol. Its IUPAC name is 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound Name7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID20858370
Molecular FormulaC20H19ClN2
Molecular Weight322.84 g/mol
Exact Mass322.12
IUPAC Name7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine
SMILESCc1ccccc1Nc1c2c(nc3ccc(Cl)cc13)CCCC2
InChIInChI=1S/C20H19ClN2/c1-13-6-2-4-8-17(13)23-20-15-7-3-5-9-18(15)22-19-11-10-14(21)12-16(19)20/h2,4,6,8,10-12H,3,5,7,9H2,1H3,(H,22,23)
InChIKeyNBZRXAJOTZHTLL-UHFFFAOYSA-N
XLogP5.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.84
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine with MolForge

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Related Compounds

7-chloro-N-(2-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 15993644
7-chloro-N-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 62202376
6-chloro-N-(2-methoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine
CID 20859019
7-chloro-N-(3-ethylphenyl)-1,2,3,4-tetrahydroacridin-9-amine
CID 20858368
N-(5-chloro-2-methoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 4060631
2-chloro-11-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline
CID 2566475
N-(3-chloro-4-fluorophenyl)-1,2,3,4-tetrahydroacridin-9-amine
CID 3658778
N-(4-chlorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine;hydrochloride
CID 2790059
N-(2-methoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 720949
7-chloro-N-(2-hydroxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 108799537
N-(3-methylphenyl)-12-azatricyclo[9.8.0.013,18]nonadeca-1(19),11,13,15,17-pentaen-19-amine
CID 134912890
7-chloro-N-(2-propan-2-ylphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 108786414

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine (CID 20858370) is 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine is Cc1ccccc1Nc1c2c(nc3ccc(Cl)cc13)CCCC2.
What is the InChIKey of 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is NBZRXAJOTZHTLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2/c1-13-6-2-4-8-17(13)23-20-15-7-3-5-9-18(15)22-19-11-10-14(21)12-16(19)20/h2,4,6,8,10-12H,3,5,7,9H2,1H3,(H,22,23).
What are the key properties of 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine?
7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 322.84 g/mol, XLogP of 5.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(2-methylphenyl)-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 20858370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).