N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide

C22H23NO2 — CID 2297093

IUPACN-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide
SMILESCCCc1ccc(OCCNC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C22H23NO2/c1-2-6-17-11-13-19(14-12-17)25-16-15-23-22(24)21-10-5-8-18-7-3-4-9-20(18)21/h3-5,7-14H,2,6,15-16H2,1H3,(H,23,24)
InChIKeyCIXUXVIWBKBWEY-UHFFFAOYSA-N
MW333.43 g/mol
LogP4.60
Rot. Bonds7

About N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide

N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide (PubChem CID 2297093) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide
PubChem CID2297093
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide
SMILESCCCc1ccc(OCCNC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C22H23NO2/c1-2-6-17-11-13-19(14-12-17)25-16-15-23-22(24)21-10-5-8-18-7-3-4-9-20(18)21/h3-5,7-14H,2,6,15-16H2,1H3,(H,23,24)
InChIKeyCIXUXVIWBKBWEY-UHFFFAOYSA-N
XLogP4.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[2-(4-propylphenoxy)ethyl]naphthalene-1-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-[2-(4-methoxyphenyl)ethyl]naphthalene-1-carboxamide
CID 2231008
2-(4-phenylphenyl)-N-[2-(4-propylphenoxy)ethyl]acetamide
CID 100517253
N-[2-(4-ethylphenoxy)ethyl]-2,3-dimethoxybenzamide
CID 100531701
N-[2-[4-(4-methylphenoxy)butanoylamino]ethyl]naphthalene-1-carboxamide
CID 108541646
butyl N-[2-(naphthalene-1-carbonylamino)ethyl]carbamate
CID 108573171
1-methyl-3-[2-(4-propylphenoxy)ethyl]urea
CID 70468541
2-naphthalen-2-yloxy-N-[2-(4-propylphenoxy)ethyl]butanamide
CID 133240086
N-dodecylnaphthalene-1-carboxamide
CID 4278758
2-ethoxy-N-[2-(4-ethoxyphenoxy)ethyl]benzamide
CID 27853054
ethane;N-ethylnaphthalene-1-carboxamide;propane
CID 144944456
N'-(4-hexadecoxybenzoyl)naphthalene-1-carbohydrazide
CID 162371332
N-[2-[(4-ethoxyphenyl)sulfonylamino]ethyl]naphthalene-1-carboxamide
CID 108573152

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide?
The IUPAC name of N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide (CID 2297093) is N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide is CCCc1ccc(OCCNC(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide?
The InChIKey is CIXUXVIWBKBWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c1-2-6-17-11-13-19(14-12-17)25-16-15-23-22(24)21-10-5-8-18-7-3-4-9-20(18)21/h3-5,7-14H,2,6,15-16H2,1H3,(H,23,24).
What are the key properties of N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide?
N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 4.60, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-propylphenoxy)ethyl]naphthalene-1-carboxamide is sourced from PubChem (CID 2297093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).