N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride

C21H22ClN3O — CID 44533160

IUPACN-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride
SMILESCl.Nc1c2c(nc3ccc(NC(=O)Cc4ccccc4)cc13)CCCC2
InChIInChI=1S/C21H21N3O.ClH/c22-21-16-8-4-5-9-18(16)24-19-11-10-15(13-17(19)21)23-20(25)12-14-6-2-1-3-7-14;/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H2,22,24)(H,23,25);1H
InChIKeyDZJGGZIRSRHDCP-UHFFFAOYSA-N
MW367.88 g/mol
LogP4.30
Rot. Bonds3

About N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride

N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride (PubChem CID 44533160) has the molecular formula C21H22ClN3O and a molecular weight of 367.88 g/mol. Its IUPAC name is N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride
PubChem CID44533160
Molecular FormulaC21H22ClN3O
Molecular Weight367.88 g/mol
Exact Mass367.15
IUPAC NameN-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride
SMILESCl.Nc1c2c(nc3ccc(NC(=O)Cc4ccccc4)cc13)CCCC2
InChIInChI=1S/C21H21N3O.ClH/c22-21-16-8-4-5-9-18(16)24-19-11-10-15(13-17(19)21)23-20(25)12-14-6-2-1-3-7-14;/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H2,22,24)(H,23,25);1H
InChIKeyDZJGGZIRSRHDCP-UHFFFAOYSA-N
XLogP4.30
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.88
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride?
The IUPAC name of N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride (CID 44533160) is N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride.
What is the SMILES notation for N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride?
The canonical SMILES for N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride is Cl.Nc1c2c(nc3ccc(NC(=O)Cc4ccccc4)cc13)CCCC2.
What is the InChIKey of N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride?
The InChIKey is DZJGGZIRSRHDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O.ClH/c22-21-16-8-4-5-9-18(16)24-19-11-10-15(13-17(19)21)23-20(25)12-14-6-2-1-3-7-14;/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H2,22,24)(H,23,25);1H.
What are the key properties of N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride?
N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride has a molecular weight of 367.88 g/mol, XLogP of 4.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 44533160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).