N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide

C20H18N2O2 — CID 3678676

IUPACN-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1c2c(nc3ccccc13)CCCC2
InChIInChI=1S/C20H18N2O2/c23-14-11-9-13(10-12-14)21-20(24)19-15-5-1-3-7-17(15)22-18-8-4-2-6-16(18)19/h1,3,5,7,9-12,23H,2,4,6,8H2,(H,21,24)
InChIKeyLYGAWNKCMWBWDQ-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.07
Rot. Bonds2

About N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide

N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide (PubChem CID 3678676) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
PubChem CID3678676
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1c2c(nc3ccccc13)CCCC2
InChIInChI=1S/C20H18N2O2/c23-14-11-9-13(10-12-14)21-20(24)19-15-5-1-3-7-17(15)22-18-8-4-2-6-16(18)19/h1,3,5,7,9-12,23H,2,4,6,8H2,(H,21,24)
InChIKeyLYGAWNKCMWBWDQ-UHFFFAOYSA-N
XLogP4.07
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide 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

N-phenyl-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 775717
methyl 4-(1,2,3,4-tetrahydroacridine-9-carbonylamino)benzoate
CID 9247815
N'-phenyl-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 21203873
N-(4-ethoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 2314335
N-(4-morpholin-4-ylphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 8961124
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 55864343
N-(2,4-difluorophenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 9247827
2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
CID 14385689
N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 2115782
1,2,3,4-tetrahydroacridine-9-carboxylic acid;hydrate
CID 16667447
N'-(4-methylbenzoyl)-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 9247855
N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 3359610

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide (CID 3678676) is N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide is O=C(Nc1ccc(O)cc1)c1c2c(nc3ccccc13)CCCC2.
What is the InChIKey of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
The InChIKey is LYGAWNKCMWBWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c23-14-11-9-13(10-12-14)21-20(24)19-15-5-1-3-7-17(15)22-18-8-4-2-6-16(18)19/h1,3,5,7,9-12,23H,2,4,6,8H2,(H,21,24).
What are the key properties of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 4.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide is sourced from PubChem (CID 3678676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).