2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide

C19H21FN2O2 — CID 119512916

IUPAC2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCOc1ccc(-c2ccc(C(=O)NCC3CCCN3)c(F)c2)cc1
InChIInChI=1S/C19H21FN2O2/c1-24-16-7-4-13(5-8-16)14-6-9-17(18(20)11-14)19(23)22-12-15-3-2-10-21-15/h4-9,11,15,21H,2-3,10,12H2,1H3,(H,22,23)
InChIKeyMPCOEJLTNNZIFJ-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.98
Rot. Bonds5

About 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide

2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide (PubChem CID 119512916) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide
PubChem CID119512916
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC Name2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCOc1ccc(-c2ccc(C(=O)NCC3CCCN3)c(F)c2)cc1
InChIInChI=1S/C19H21FN2O2/c1-24-16-7-4-13(5-8-16)14-6-9-17(18(20)11-14)19(23)22-12-15-3-2-10-21-15/h4-9,11,15,21H,2-3,10,12H2,1H3,(H,22,23)
InChIKeyMPCOEJLTNNZIFJ-UHFFFAOYSA-N
XLogP2.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide 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

2,4-difluoro-N-(pyrrolidin-2-ylmethyl)benzamide
CID 62542167
2-fluoro-4-(4-methoxyphenyl)-N-[(5-methylpyrrolidin-3-yl)methyl]benzamide
CID 167941997
2-fluoro-4-methyl-N-(piperidin-2-ylmethyl)benzamide;hydrochloride
CID 84586603
7-methoxy-2-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]quinoline-4-carboxamide
CID 119071112
5-chloro-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119513727
2-fluoro-4-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607793
2-fluoro-4-methoxy-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609970
1-[(4-methoxyphenyl)methyl]-3-(pyrrolidin-2-ylmethyl)urea
CID 117235618
3-(4-fluorophenyl)-N-[[(2S)-pyrrolidin-2-yl]methyl]benzamide;hydrochloride
CID 154911098
N-(3-amino-2-methylpropyl)-2-fluoro-4-(4-methoxyphenyl)benzamide
CID 119997586
2,3,4-trifluoro-N-(piperidin-2-ylmethyl)benzamide
CID 79749991
4,5-difluoro-2-iodo-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119510965

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide?
The IUPAC name of 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide (CID 119512916) is 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide?
The canonical SMILES for 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide is COc1ccc(-c2ccc(C(=O)NCC3CCCN3)c(F)c2)cc1.
What is the InChIKey of 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide?
The InChIKey is MPCOEJLTNNZIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-24-16-7-4-13(5-8-16)14-6-9-17(18(20)11-14)19(23)22-12-15-3-2-10-21-15/h4-9,11,15,21H,2-3,10,12H2,1H3,(H,22,23).
What are the key properties of 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide?
2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide has a molecular weight of 328.39 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)benzamide is sourced from PubChem (CID 119512916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).