N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide

C20H27FN2OS — CID 110301477

IUPACN-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide
SMILESCCN(CC)C(C)CNC(=O)C(Cc1cccs1)c1ccc(F)cc1
InChIInChI=1S/C20H27FN2OS/c1-4-23(5-2)15(3)14-22-20(24)19(13-18-7-6-12-25-18)16-8-10-17(21)11-9-16/h6-12,15,19H,4-5,13-14H2,1-3H3,(H,22,24)
InChIKeyBTNZHKGYBZWONW-UHFFFAOYSA-N
MW362.51 g/mol
LogP4.06
Rot. Bonds9

About N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide

N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide (PubChem CID 110301477) has the molecular formula C20H27FN2OS and a molecular weight of 362.51 g/mol. Its IUPAC name is N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide
PubChem CID110301477
Molecular FormulaC20H27FN2OS
Molecular Weight362.51 g/mol
Exact Mass362.18
IUPAC NameN-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide
SMILESCCN(CC)C(C)CNC(=O)C(Cc1cccs1)c1ccc(F)cc1
InChIInChI=1S/C20H27FN2OS/c1-4-23(5-2)15(3)14-22-20(24)19(13-18-7-6-12-25-18)16-8-10-17(21)11-9-16/h6-12,15,19H,4-5,13-14H2,1-3H3,(H,22,24)
InChIKeyBTNZHKGYBZWONW-UHFFFAOYSA-N
XLogP4.06
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.51
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide 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-(diethylamino)propyl]-2-(4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 110301478
N-[2-(dimethylamino)-2-methylpropyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide
CID 110303228
2-(4-fluorophenyl)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]-3-thiophen-2-ylpropanamide
CID 110310259
2-[ethyl-[1-(4-fluorophenyl)ethyl]amino]-N-(thiophen-2-ylmethylcarbamoyl)acetamide
CID 55838696
N-[2-(4-fluorophenyl)-3-thiophen-2-ylpropyl]-2-methylpropan-1-amine
CID 79437960
4-amino-2-(4-fluorophenyl)-N-(2-methylpropyl)butanamide
CID 112516304
2-[1-(4-fluorophenyl)-1-oxo-3-thiophen-2-ylpropan-2-yl]-4-methyl-3-oxo-N-(thiophen-2-ylmethyl)pentanamide
CID 19877423
2-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]-3-thiophen-2-ylpropanamide
CID 110296913
(2S)-2-[ethyl(thiophen-2-ylmethyl)amino]-N-(4-propan-2-ylphenyl)propanamide
CID 8718457
N-[2-(diethylamino)propyl]-5-oxo-5-thiophen-2-ylpentanamide
CID 110301508
3-[2-(4-fluorophenyl)butanoylamino]-2-phenylpropanoic acid
CID 120528828
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide?
The IUPAC name of N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide (CID 110301477) is N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide is CCN(CC)C(C)CNC(=O)C(Cc1cccs1)c1ccc(F)cc1.
What is the InChIKey of N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide?
The InChIKey is BTNZHKGYBZWONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27FN2OS/c1-4-23(5-2)15(3)14-22-20(24)19(13-18-7-6-12-25-18)16-8-10-17(21)11-9-16/h6-12,15,19H,4-5,13-14H2,1-3H3,(H,22,24).
What are the key properties of N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide?
N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide has a molecular weight of 362.51 g/mol, XLogP of 4.06, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 110301477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).