N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide

C19H21FN2O3 — CID 110361803

IUPACN-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(N3CCCC3)ccc2F)cc1OC
InChIInChI=1S/C19H21FN2O3/c1-24-17-8-5-13(11-18(17)25-2)19(23)21-16-12-14(6-7-15(16)20)22-9-3-4-10-22/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23)
InChIKeyWNZLQRAVFWAQHL-UHFFFAOYSA-N
MW344.39 g/mol
LogP3.70
Rot. Bonds5

About N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide

N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide (PubChem CID 110361803) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
PubChem CID110361803
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(N3CCCC3)ccc2F)cc1OC
InChIInChI=1S/C19H21FN2O3/c1-24-17-8-5-13(11-18(17)25-2)19(23)21-16-12-14(6-7-15(16)20)22-9-3-4-10-22/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23)
InChIKeyWNZLQRAVFWAQHL-UHFFFAOYSA-N
XLogP3.70
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide 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-fluoro-5-piperidin-1-ylphenyl)-3,4,5-trimethoxybenzamide
CID 110362244
N-(2-fluoro-5-piperidin-1-ylphenyl)-2-(2-methoxyphenoxy)acetamide
CID 110362257
3-methoxy-4-methyl-N-(2-methyl-4-pyrrolidin-1-ylphenyl)benzamide
CID 42039924
3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide
CID 110359680
N-(2-fluoro-5-morpholin-4-ylphenyl)-4-methoxybenzamide
CID 110362600
3,4,5-trimethoxy-N-(2-methyl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110361706
3,4-dimethoxy-N-(2,3,4-trifluorophenyl)benzamide
CID 4879673
4-(2-amino-2-oxoethoxy)-3-methoxy-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 17481283
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 110361821
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide
CID 110361842
N-(5-chloro-2-piperidin-1-ylphenyl)-3-(difluoromethoxy)-4-methoxybenzamide
CID 55754662
3-(difluoromethoxy)-N-[2-fluoro-5-(tetrazol-1-yl)phenyl]-4-methoxybenzamide
CID 51123666

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide (CID 110361803) is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2cc(N3CCCC3)ccc2F)cc1OC.
What is the InChIKey of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide?
The InChIKey is WNZLQRAVFWAQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-24-17-8-5-13(11-18(17)25-2)19(23)21-16-12-14(6-7-15(16)20)22-9-3-4-10-22/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,23).
What are the key properties of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide?
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide has a molecular weight of 344.39 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 110361803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).