N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide

C18H14Cl2N2O — CID 27161017

IUPACN-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide
SMILESNc1c(Cl)cc(NC(=O)Cc2ccc3ccccc3c2)cc1Cl
InChIInChI=1S/C18H14Cl2N2O/c19-15-9-14(10-16(20)18(15)21)22-17(23)8-11-5-6-12-3-1-2-4-13(12)7-11/h1-7,9-10H,8,21H2,(H,22,23)
InChIKeyHJTWCZZYKUCQQU-UHFFFAOYSA-N
MW345.23 g/mol
LogP4.91
Rot. Bonds3

About N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide

N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide (PubChem CID 27161017) has the molecular formula C18H14Cl2N2O and a molecular weight of 345.23 g/mol. Its IUPAC name is N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide
PubChem CID27161017
Molecular FormulaC18H14Cl2N2O
Molecular Weight345.23 g/mol
Exact Mass344.05
IUPAC NameN-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide
SMILESNc1c(Cl)cc(NC(=O)Cc2ccc3ccccc3c2)cc1Cl
InChIInChI=1S/C18H14Cl2N2O/c19-15-9-14(10-16(20)18(15)21)22-17(23)8-11-5-6-12-3-1-2-4-13(12)7-11/h1-7,9-10H,8,21H2,(H,22,23)
InChIKeyHJTWCZZYKUCQQU-UHFFFAOYSA-N
XLogP4.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.23
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide 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-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
N-(4-amino-3,5-dichlorophenyl)-2-(2-chlorophenyl)acetamide
CID 46665625
2-(3,4-dichlorophenyl)-N-naphthalen-2-ylacetamide
CID 7900527
N-(4-acetamidophenyl)-2-naphthalen-2-ylacetamide
CID 26499620
N-(4-methylphenyl)-2-naphthalen-2-ylacetamide
CID 9411639
2-naphthalen-2-yl-N-pyridin-4-ylacetamide
CID 25336159
2-[4-[(2-naphthalen-2-ylacetyl)amino]phenyl]acetic acid
CID 6461297
N-(3-hydroxyphenyl)-2-naphthalen-2-ylacetamide
CID 28739776
N-(4-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 16849660
N-(3-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 9165110
N-naphthalen-1-yl-2-naphthalen-2-ylacetamide
CID 16849654
N-(4-ethoxyphenyl)-2-naphthalen-2-ylacetamide
CID 2992988

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide (CID 27161017) is N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide is Nc1c(Cl)cc(NC(=O)Cc2ccc3ccccc3c2)cc1Cl.
What is the InChIKey of N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide?
The InChIKey is HJTWCZZYKUCQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O/c19-15-9-14(10-16(20)18(15)21)22-17(23)8-11-5-6-12-3-1-2-4-13(12)7-11/h1-7,9-10H,8,21H2,(H,22,23).
What are the key properties of N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide?
N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide has a molecular weight of 345.23 g/mol, XLogP of 4.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-3,5-dichlorophenyl)-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 27161017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).