N-[4-[3-(diethylamino)propoxy]phenyl]propanamide

C16H26N2O2 — CID 174597936

IUPACN-[4-[3-(diethylamino)propoxy]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(OCCCN(CC)CC)cc1
InChIInChI=1S/C16H26N2O2/c1-4-16(19)17-14-8-10-15(11-9-14)20-13-7-12-18(5-2)6-3/h8-11H,4-7,12-13H2,1-3H3,(H,17,19)
InChIKeyCEPDSENGROZAKX-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.15
Rot. Bonds9

About N-[4-[3-(diethylamino)propoxy]phenyl]propanamide

N-[4-[3-(diethylamino)propoxy]phenyl]propanamide (PubChem CID 174597936) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[4-[3-(diethylamino)propoxy]phenyl]propanamide.

Molecular Properties

Compound NameN-[4-[3-(diethylamino)propoxy]phenyl]propanamide
PubChem CID174597936
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[4-[3-(diethylamino)propoxy]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(OCCCN(CC)CC)cc1
InChIInChI=1S/C16H26N2O2/c1-4-16(19)17-14-8-10-15(11-9-14)20-13-7-12-18(5-2)6-3/h8-11H,4-7,12-13H2,1-3H3,(H,17,19)
InChIKeyCEPDSENGROZAKX-UHFFFAOYSA-N
XLogP3.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[4-[3-(diethylamino)propoxy]phenyl]propanamide 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-[4-[3-(diethylamino)propoxy]phenyl]-1-phenylcyclopentane-1-carboxamide
CID 100658332
N-[4-[[2-(4-butoxyanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54835555
methyl 4-[3-(diethylamino)propoxy]benzoate
CID 18508138
N-[4-[3-(diethylamino)propoxy]phenyl]-2-methoxy-2-methylpentanamide
CID 133245961
N-[4-[2-(diethylamino)ethoxy]phenyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430502
N-[4-[3-(diethylamino)propoxy]phenyl]-1-ethoxycycloheptane-1-carboxamide
CID 100731388
1-[4-[3-(diethylamino)propoxy]phenyl]ethanone;methane
CID 161301503
N-[4-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]phenyl]propanamide
CID 153330481
N-(4-butoxyphenyl)butanamide
CID 4939679
1-[3-(diethylamino)propyl]-3-(4-ethoxyphenyl)urea
CID 3669043
2-(diethylamino)ethyl N-(4-hexoxyphenyl)carbamate;hydrochloride
CID 24836482
2-bromo-1-[4-[3-(diethylamino)propoxy]phenyl]ethanone
CID 86591969

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(diethylamino)propoxy]phenyl]propanamide?
The IUPAC name of N-[4-[3-(diethylamino)propoxy]phenyl]propanamide (CID 174597936) is N-[4-[3-(diethylamino)propoxy]phenyl]propanamide.
What is the SMILES notation for N-[4-[3-(diethylamino)propoxy]phenyl]propanamide?
The canonical SMILES for N-[4-[3-(diethylamino)propoxy]phenyl]propanamide is CCC(=O)Nc1ccc(OCCCN(CC)CC)cc1.
What is the InChIKey of N-[4-[3-(diethylamino)propoxy]phenyl]propanamide?
The InChIKey is CEPDSENGROZAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-16(19)17-14-8-10-15(11-9-14)20-13-7-12-18(5-2)6-3/h8-11H,4-7,12-13H2,1-3H3,(H,17,19).
What are the key properties of N-[4-[3-(diethylamino)propoxy]phenyl]propanamide?
N-[4-[3-(diethylamino)propoxy]phenyl]propanamide has a molecular weight of 278.40 g/mol, XLogP of 3.15, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(diethylamino)propoxy]phenyl]propanamide is sourced from PubChem (CID 174597936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).