N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide

C23H22FNO2S — CID 25290549

IUPACN-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)N(Cc2cccc(OCc3ccccc3F)c2)C2CC2)s1
InChIInChI=1S/C23H22FNO2S/c1-16-9-12-22(28-16)23(26)25(19-10-11-19)14-17-5-4-7-20(13-17)27-15-18-6-2-3-8-21(18)24/h2-9,12-13,19H,10-11,14-15H2,1H3
InChIKeyAULNAVNXFVUKHL-UHFFFAOYSA-N
MW395.50 g/mol
LogP5.58
Rot. Bonds7

About N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide

N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide (PubChem CID 25290549) has the molecular formula C23H22FNO2S and a molecular weight of 395.50 g/mol. Its IUPAC name is N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide
PubChem CID25290549
Molecular FormulaC23H22FNO2S
Molecular Weight395.50 g/mol
Exact Mass395.14
IUPAC NameN-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)N(Cc2cccc(OCc3ccccc3F)c2)C2CC2)s1
InChIInChI=1S/C23H22FNO2S/c1-16-9-12-22(28-16)23(26)25(19-10-11-19)14-17-5-4-7-20(13-17)27-15-18-6-2-3-8-21(18)24/h2-9,12-13,19H,10-11,14-15H2,1H3
InChIKeyAULNAVNXFVUKHL-UHFFFAOYSA-N
XLogP5.58
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.50
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-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-cyclopropyl-N-[(4-fluorophenyl)methyl]-5-methylthiophene-2-carboxamide
CID 78814368
N-cyclopropyl-N-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]-5-methylthiophene-2-carboxamide
CID 26275149
N-cyclopropyl-N-[[4-[2-(4-fluorophenyl)ethoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide
CID 42461386
N-cyclopropyl-N-[(2-fluorophenyl)methyl]-3-propoxybenzamide
CID 55772522
N-cyclopentyl-N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-methylpropanamide
CID 42500679
N-[[3-[2-(2-fluorophenyl)ethoxy]phenyl]methyl]-3-methyl-N-[(3S)-2-oxoazepan-3-yl]thiophene-2-carboxamide
CID 42342607
[3-[(2-fluorophenyl)methoxy]phenyl]methyl-[(4-methylphenyl)methyl]azanium
CID 8635433
(2S)-2-[[3-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-methylbutanoic acid
CID 99124267
5-methyl-N-[[3-[[(3S)-oxolan-3-yl]methoxy]phenyl]methyl]-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
CID 26353603
N-cyclopropyl-5-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide
CID 33351813
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 146264047
N-[(2-fluorophenyl)methyl]-N-methyl-3-phenylmethoxybenzamide
CID 30253357

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide (CID 25290549) is N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)N(Cc2cccc(OCc3ccccc3F)c2)C2CC2)s1.
What is the InChIKey of N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide?
The InChIKey is AULNAVNXFVUKHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FNO2S/c1-16-9-12-22(28-16)23(26)25(19-10-11-19)14-17-5-4-7-20(13-17)27-15-18-6-2-3-8-21(18)24/h2-9,12-13,19H,10-11,14-15H2,1H3.
What are the key properties of N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide?
N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide has a molecular weight of 395.50 g/mol, XLogP of 5.58, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 25290549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).