N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide

C17H17N3O2 — CID 134039640

IUPACN-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide
SMILESO=C(NCCc1nccn1Cc1ccccc1)c1ccco1
InChIInChI=1S/C17H17N3O2/c21-17(15-7-4-12-22-15)19-9-8-16-18-10-11-20(16)13-14-5-2-1-3-6-14/h1-7,10-12H,8-9,13H2,(H,19,21)
InChIKeyMGCAKXLCCPYSSX-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.50
Rot. Bonds6

About N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide

N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide (PubChem CID 134039640) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide
PubChem CID134039640
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC NameN-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide
SMILESO=C(NCCc1nccn1Cc1ccccc1)c1ccco1
InChIInChI=1S/C17H17N3O2/c21-17(15-7-4-12-22-15)19-9-8-16-18-10-11-20(16)13-14-5-2-1-3-6-14/h1-7,10-12H,8-9,13H2,(H,19,21)
InChIKeyMGCAKXLCCPYSSX-UHFFFAOYSA-N
XLogP2.50
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide
CID 134027637
N-[2-(1-benzylimidazol-2-yl)ethyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86852704
N-[2-(1-benzylimidazol-2-yl)ethyl]acetamide;ethane
CID 144709422
N-[2-(1-benzylimidazol-2-yl)ethyl]pyridine-3-carboxamide
CID 134039644
N-[2-(1-benzylimidazol-2-yl)ethyl]-2-chloro-4,5-difluorobenzamide
CID 134039701
N-[2-(1-benzylimidazol-2-yl)ethyl]-1-phenylpyrazole-4-carboxamide
CID 134027595
N-[2-(1-benzylimidazol-2-yl)ethyl]-2-hydroxy-5-methylbenzamide
CID 134027428
N-[2-(1-benzylimidazol-2-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 134027547
N-[2-(1-benzylimidazol-2-yl)ethyl]-4-[(prop-2-enoylamino)methyl]benzamide
CID 86839804
N-[3-(2-ethylimidazol-1-yl)propyl]furan-2-carboxamide
CID 13371088
N-[2-(1-benzylimidazol-2-yl)ethyl]-3,5-dimethoxy-4-methylbenzamide
CID 134039597
N-[2-(1-benzylimidazol-2-yl)ethyl]-3-phenoxybenzamide
CID 25358093

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide (CID 134039640) is N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide is O=C(NCCc1nccn1Cc1ccccc1)c1ccco1.
What is the InChIKey of N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide?
The InChIKey is MGCAKXLCCPYSSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c21-17(15-7-4-12-22-15)19-9-8-16-18-10-11-20(16)13-14-5-2-1-3-6-14/h1-7,10-12H,8-9,13H2,(H,19,21).
What are the key properties of N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide?
N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide has a molecular weight of 295.34 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 134039640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).