5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide

C20H21N3O2 — CID 86777635

IUPAC5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide
SMILESO=C(NC1(c2ccccc2)CCCC1)c1ccc(Cn2ccnc2)o1
InChIInChI=1S/C20H21N3O2/c24-19(18-9-8-17(25-18)14-23-13-12-21-15-23)22-20(10-4-5-11-20)16-6-2-1-3-7-16/h1-3,6-9,12-13,15H,4-5,10-11,14H2,(H,22,24)
InChIKeyMPGSOIUYLWMENU-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.72
Rot. Bonds5

About 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide

5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide (PubChem CID 86777635) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide
PubChem CID86777635
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide
SMILESO=C(NC1(c2ccccc2)CCCC1)c1ccc(Cn2ccnc2)o1
InChIInChI=1S/C20H21N3O2/c24-19(18-9-8-17(25-18)14-23-13-12-21-15-23)22-20(10-4-5-11-20)16-6-2-1-3-7-16/h1-3,6-9,12-13,15H,4-5,10-11,14H2,(H,22,24)
InChIKeyMPGSOIUYLWMENU-UHFFFAOYSA-N
XLogP3.72
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 95379084
N-[1-[5-(imidazol-1-ylmethyl)furan-2-carbonyl]-3-(1-methoxycyclopropyl)azetidin-3-yl]benzamide
CID 155881053
N-[1-(hydroxymethyl)cyclopentyl]-4-(imidazol-1-ylmethyl)benzamide
CID 110008830
5-bromo-N-(1-phenylcyclobutyl)furan-2-carboxamide
CID 51273024
5-(imidazol-1-ylmethyl)-N-[[(3S)-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl]methyl]furan-2-carboxamide
CID 95426777
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 78839450
cis-methyl (1R,2S)-2-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]cycloheptane-1-carboxylate
CID 97053856
5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide
CID 118795926
[5-(imidazol-1-ylmethyl)furan-2-yl]-(2-pyridin-2-ylpyrrolidin-1-yl)methanone
CID 56879395
N-(1-phenylcyclopentyl)pyrimidine-5-carboxamide
CID 110466935
methyl (1S,2R,3R,4S)-3-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylate
CID 129432761
methyl (1S,2S,3S,4S)-3-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylate
CID 98515091

Frequently Asked Questions

What is the IUPAC name of 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide?
The IUPAC name of 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide (CID 86777635) is 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide.
What is the SMILES notation for 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide?
The canonical SMILES for 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide is O=C(NC1(c2ccccc2)CCCC1)c1ccc(Cn2ccnc2)o1.
What is the InChIKey of 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide?
The InChIKey is MPGSOIUYLWMENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c24-19(18-9-8-17(25-18)14-23-13-12-21-15-23)22-20(10-4-5-11-20)16-6-2-1-3-7-16/h1-3,6-9,12-13,15H,4-5,10-11,14H2,(H,22,24).
What are the key properties of 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide?
5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide is sourced from PubChem (CID 86777635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).