N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide

C19H21N3O2 — CID 134027637

IUPACN-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide
SMILESO=C(CCc1ccco1)NCCc1nccn1Cc1ccccc1
InChIInChI=1S/C19H21N3O2/c23-19(9-8-17-7-4-14-24-17)21-11-10-18-20-12-13-22(18)15-16-5-2-1-3-6-16/h1-7,12-14H,8-11,15H2,(H,21,23)
InChIKeyMEZYKWSRYRSMJX-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.82
Rot. Bonds8

About N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide

N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide (PubChem CID 134027637) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide
PubChem CID134027637
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide
SMILESO=C(CCc1ccco1)NCCc1nccn1Cc1ccccc1
InChIInChI=1S/C19H21N3O2/c23-19(9-8-17-7-4-14-24-17)21-11-10-18-20-12-13-22(18)15-16-5-2-1-3-6-16/h1-7,12-14H,8-11,15H2,(H,21,23)
InChIKeyMEZYKWSRYRSMJX-UHFFFAOYSA-N
XLogP2.82
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-benzylimidazol-2-yl)ethyl]furan-2-carboxamide
CID 134039640
N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(3,5-dimethoxyphenyl)propanamide
CID 134027600
N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 134039804
N-[2-(1-benzylimidazol-2-yl)ethyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86852704
N-[4-[2-(1-benzylimidazol-2-yl)ethylamino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 134039836
N-[2-(1-benzylimidazol-2-yl)ethyl]acetamide;ethane
CID 144709422
N-[2-(1-benzylimidazol-2-yl)ethyl]-4-(4-ethylphenyl)-4-oxobutanamide
CID 134039594
N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(4-fluorophenyl)sulfanylpropanamide
CID 134039558
3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
CID 30102772
N-[2-(1-benzylimidazol-2-yl)ethyl]-2-pyrrolidin-3-ylacetamide
CID 126773827
1-[2-(1-benzylimidazol-2-yl)ethyl]-3-[3-(furan-2-ylmethoxy)propyl]-2-methylguanidine;hydroiodide
CID 111398998
3-(furan-2-yl)-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]propanamide
CID 51279582

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide?
The IUPAC name of N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide (CID 134027637) is N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide.
What is the SMILES notation for N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide?
The canonical SMILES for N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide is O=C(CCc1ccco1)NCCc1nccn1Cc1ccccc1.
What is the InChIKey of N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide?
The InChIKey is MEZYKWSRYRSMJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c23-19(9-8-17-7-4-14-24-17)21-11-10-18-20-12-13-22(18)15-16-5-2-1-3-6-16/h1-7,12-14H,8-11,15H2,(H,21,23).
What are the key properties of N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide?
N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide has a molecular weight of 323.40 g/mol, XLogP of 2.82, 8 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]-3-(furan-2-yl)propanamide is sourced from PubChem (CID 134027637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).