5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride

C18H23ClN2O2 — CID 119552942

IUPAC5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
SMILESCCc1ccc(-c2ccc(C(=O)N(C)C3CCNC3)o2)cc1.Cl
InChIInChI=1S/C18H22N2O2.ClH/c1-3-13-4-6-14(7-5-13)16-8-9-17(22-16)18(21)20(2)15-10-11-19-12-15;/h4-9,15,19H,3,10-12H2,1-2H3;1H
InChIKeyRZLCTHCWVRXJFL-UHFFFAOYSA-N
MW334.85 g/mol
LogP3.36
Rot. Bonds4

About 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride

5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride (PubChem CID 119552942) has the molecular formula C18H23ClN2O2 and a molecular weight of 334.85 g/mol. Its IUPAC name is 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
PubChem CID119552942
Molecular FormulaC18H23ClN2O2
Molecular Weight334.85 g/mol
Exact Mass334.14
IUPAC Name5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
SMILESCCc1ccc(-c2ccc(C(=O)N(C)C3CCNC3)o2)cc1.Cl
InChIInChI=1S/C18H22N2O2.ClH/c1-3-13-4-6-14(7-5-13)16-8-9-17(22-16)18(21)20(2)15-10-11-19-12-15;/h4-9,15,19H,3,10-12H2,1-2H3;1H
InChIKeyRZLCTHCWVRXJFL-UHFFFAOYSA-N
XLogP3.36
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.85
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 21034256
5-ethyl-N-methyl-N-piperidin-4-ylfuran-2-carboxamide
CID 79094742
5-(4-ethylphenyl)-N-(3-methylpiperidin-4-yl)furan-2-carboxamide
CID 120553771
N-methyl-2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 55027680
5-[(4-fluorophenoxy)methyl]-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride
CID 119549878
N-methyl-4-(5-methylfuran-2-yl)-N-piperidin-4-ylbenzamide;hydrochloride
CID 154900847
4-(methoxymethyl)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119553670
5-bromo-N-methyl-N-piperidin-4-ylfuran-2-carboxamide
CID 43602151
2-[[5-(4-ethylphenyl)furan-2-carbonyl]-methylamino]propanoic acid
CID 119209158
N-methyl-N-pyrrolidin-3-yl-2-[4-(trifluoromethoxy)phenyl]acetamide;hydrochloride
CID 119554562
N-(azetidin-3-yl)-5-chloro-N-methylfuran-2-carboxamide
CID 66185904
N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
CID 119551120

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
The IUPAC name of 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride (CID 119552942) is 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride.
What is the SMILES notation for 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
The canonical SMILES for 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride is CCc1ccc(-c2ccc(C(=O)N(C)C3CCNC3)o2)cc1.Cl.
What is the InChIKey of 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
The InChIKey is RZLCTHCWVRXJFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2.ClH/c1-3-13-4-6-14(7-5-13)16-8-9-17(22-16)18(21)20(2)15-10-11-19-12-15;/h4-9,15,19H,3,10-12H2,1-2H3;1H.
What are the key properties of 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride?
5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride has a molecular weight of 334.85 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylfuran-2-carboxamide;hydrochloride is sourced from PubChem (CID 119552942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).