N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide

C22H28N2O4 — CID 17218273

IUPACN-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide
SMILESCCCCCOc1ccc(C(=O)Nc2ccc(C(=O)NCCOC)cc2)cc1
InChIInChI=1S/C22H28N2O4/c1-3-4-5-15-28-20-12-8-18(9-13-20)22(26)24-19-10-6-17(7-11-19)21(25)23-14-16-27-2/h6-13H,3-5,14-16H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyIMUJIVBMTPWOFM-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.88
Rot. Bonds11

About N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide

N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide (PubChem CID 17218273) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide
PubChem CID17218273
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide
SMILESCCCCCOc1ccc(C(=O)Nc2ccc(C(=O)NCCOC)cc2)cc1
InChIInChI=1S/C22H28N2O4/c1-3-4-5-15-28-20-12-8-18(9-13-20)22(26)24-19-10-6-17(7-11-19)21(25)23-14-16-27-2/h6-13H,3-5,14-16H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyIMUJIVBMTPWOFM-UHFFFAOYSA-N
XLogP3.88
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-4-[(4-propoxybenzoyl)amino]benzamide
CID 17218276
4-[(4-heptoxybenzoyl)amino]-N-propylbenzamide
CID 17218814
4-N-(4-ethoxyphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045187
4-[(4-butoxybenzoyl)carbamothioylamino]-N-(2-methoxyethyl)benzamide
CID 17218467
3-[(4-butoxybenzoyl)amino]-N-(2-methoxyethyl)benzamide
CID 17219011
N-(4-methoxyphenyl)-4-octoxybenzamide
CID 71343101
N-(4-iodophenyl)-4-pentoxybenzamide
CID 4935000
N-(4-heptoxyphenyl)-4-(4-methoxyphenyl)benzamide
CID 101044220
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
4-[[2-(4-hexoxyanilino)-2-oxoethyl]amino]-N-(3-methoxypropyl)benzamide
CID 54835385
4-pentoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 17340246
4-[(4-butoxybenzoyl)amino]-N-methylbenzamide
CID 9164625

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide?
The IUPAC name of N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide (CID 17218273) is N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide is CCCCCOc1ccc(C(=O)Nc2ccc(C(=O)NCCOC)cc2)cc1.
What is the InChIKey of N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide?
The InChIKey is IMUJIVBMTPWOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-3-4-5-15-28-20-12-8-18(9-13-20)22(26)24-19-10-6-17(7-11-19)21(25)23-14-16-27-2/h6-13H,3-5,14-16H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide?
N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide has a molecular weight of 384.48 g/mol, XLogP of 3.88, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-[(4-pentoxybenzoyl)amino]benzamide is sourced from PubChem (CID 17218273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).