5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride

C17H20ClFN2O3 — CID 119549878

IUPAC5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
SMILESCN(C(=O)c1ccc(COc2ccc(F)cc2)o1)C1CCNC1.Cl
InChIInChI=1S/C17H19FN2O3.ClH/c1-20(13-8-9-19-10-13)17(21)16-7-6-15(23-16)11-22-14-4-2-12(18)3-5-14;/h2-7,13,19H,8-11H2,1H3;1H
InChIKeyRMVAADNLWKBDRC-UHFFFAOYSA-N
MW354.81 g/mol
LogP2.85
Rot. Bonds5

About 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride

5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride (PubChem CID 119549878) has the molecular formula C17H20ClFN2O3 and a molecular weight of 354.81 g/mol. Its IUPAC name is 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
PubChem CID119549878
Molecular FormulaC17H20ClFN2O3
Molecular Weight354.81 g/mol
Exact Mass354.11
IUPAC Name5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
SMILESCN(C(=O)c1ccc(COc2ccc(F)cc2)o1)C1CCNC1.Cl
InChIInChI=1S/C17H19FN2O3.ClH/c1-20(13-8-9-19-10-13)17(21)16-7-6-15(23-16)11-22-14-4-2-12(18)3-5-14;/h2-7,13,19H,8-11H2,1H3;1H
InChIKeyRMVAADNLWKBDRC-UHFFFAOYSA-N
XLogP2.85
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.81
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(4-fluorophenoxy)methyl]-N-methyl-N-piperidin-4-ylfuran-2-carboxamide
CID 119441155
5-[(4-fluorophenoxy)methyl]-N-(2-pyrrolidin-3-ylethyl)furan-2-carboxamide
CID 119533354
2-[(4-fluorophenoxy)methyl]-N,4-dimethyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119550008
5-[(4-bromophenoxy)methyl]-N-cyclohexyl-N-methylfuran-2-carboxamide
CID 55772175
5-[(2,4-dimethylphenoxy)methyl]-N-methyl-N-piperidin-4-ylfuran-2-carboxamide;hydrochloride
CID 119444065
5-ethyl-N-methyl-N-piperidin-4-ylfuran-2-carboxamide
CID 79094742
N-benzyl-5-[(4-fluorophenoxy)methyl]-N-methylfuran-2-carboxamide
CID 51147848
5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
CID 119552942
5-[(4-fluorophenoxy)methyl]-N-(2-hydroxy-2-methylpropyl)-N-methylfuran-2-carboxamide
CID 111579452
N-cyclohexyl-5-[(3,4-dimethylphenoxy)methyl]-N-methylfuran-2-carboxamide
CID 717036
N-(3-amino-2,2-dimethylpropyl)-5-[(4-fluorophenoxy)methyl]-N-methylfuran-2-carboxamide;hydrochloride
CID 119652390
4-(cyclopropylmethoxy)-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551835

Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
The IUPAC name of 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride (CID 119549878) is 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride.
What is the SMILES notation for 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
The canonical SMILES for 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride is CN(C(=O)c1ccc(COc2ccc(F)cc2)o1)C1CCNC1.Cl.
What is the InChIKey of 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
The InChIKey is RMVAADNLWKBDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3.ClH/c1-20(13-8-9-19-10-13)17(21)16-7-6-15(23-16)11-22-14-4-2-12(18)3-5-14;/h2-7,13,19H,8-11H2,1H3;1H.
What are the key properties of 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride has a molecular weight of 354.81 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride is sourced from PubChem (CID 119549878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).