N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide

C19H20FN3O2 — CID 24712897

IUPACN-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide
SMILESCC(C)N(Cc1nccn1Cc1cccc(F)c1)C(=O)c1ccco1
InChIInChI=1S/C19H20FN3O2/c1-14(2)23(19(24)17-7-4-10-25-17)13-18-21-8-9-22(18)12-15-5-3-6-16(20)11-15/h3-11,14H,12-13H2,1-2H3
InChIKeyXNUSDCIXBMKVEE-UHFFFAOYSA-N
MW341.39 g/mol
LogP3.71
Rot. Bonds6

About N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide

N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide (PubChem CID 24712897) has the molecular formula C19H20FN3O2 and a molecular weight of 341.39 g/mol. Its IUPAC name is N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide
PubChem CID24712897
Molecular FormulaC19H20FN3O2
Molecular Weight341.39 g/mol
Exact Mass341.15
IUPAC NameN-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide
SMILESCC(C)N(Cc1nccn1Cc1cccc(F)c1)C(=O)c1ccco1
InChIInChI=1S/C19H20FN3O2/c1-14(2)23(19(24)17-7-4-10-25-17)13-18-21-8-9-22(18)12-15-5-3-6-16(20)11-15/h3-11,14H,12-13H2,1-2H3
InChIKeyXNUSDCIXBMKVEE-UHFFFAOYSA-N
XLogP3.71
TPSA51.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-N-[[1-[(2-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylbenzamide
CID 46139787
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CID 42819003
N-[(1-benzylpyrrol-2-yl)methyl]-N-propan-2-ylfuran-2-carboxamide
CID 810205
N-[[1-[(3-methoxyphenyl)methyl]imidazol-2-yl]methyl]-N-prop-2-enylfuran-2-carboxamide
CID 42819878
[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methanamine
CID 62223886
N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-(2-morpholin-4-ylethyl)butanamide
CID 42819476
N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide
CID 42762739
3-ethyl-1-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-1-(2-methoxyethyl)urea
CID 42819710
N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 61215927
N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-prop-2-enylcyclopropanecarboxamide
CID 42819519
1-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-1-(2-morpholin-4-ylethyl)-3-propylurea
CID 42819707
N-[(3-fluorophenyl)methyl]-N-pyridin-2-ylfuran-2-carboxamide
CID 35578218

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide?
The IUPAC name of N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide (CID 24712897) is N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide.
What is the SMILES notation for N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide?
The canonical SMILES for N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide is CC(C)N(Cc1nccn1Cc1cccc(F)c1)C(=O)c1ccco1.
What is the InChIKey of N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide?
The InChIKey is XNUSDCIXBMKVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O2/c1-14(2)23(19(24)17-7-4-10-25-17)13-18-21-8-9-22(18)12-15-5-3-6-16(20)11-15/h3-11,14H,12-13H2,1-2H3.
What are the key properties of N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide?
N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide has a molecular weight of 341.39 g/mol, XLogP of 3.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(3-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-propan-2-ylfuran-2-carboxamide is sourced from PubChem (CID 24712897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).