N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide

C22H21NO2 — CID 3873675

IUPACN-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide
SMILESO=C(C1CC1c1ccccc1)N(Cc1ccccc1)Cc1ccco1
InChIInChI=1S/C22H21NO2/c24-22(21-14-20(21)18-10-5-2-6-11-18)23(16-19-12-7-13-25-19)15-17-8-3-1-4-9-17/h1-13,20-21H,14-16H2
InChIKeySPPQGPTUEHJRBB-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.61
Rot. Bonds6

About N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide

N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide (PubChem CID 3873675) has the molecular formula C22H21NO2 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide
PubChem CID3873675
Molecular FormulaC22H21NO2
Molecular Weight331.42 g/mol
Exact Mass331.16
IUPAC NameN-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide
SMILESO=C(C1CC1c1ccccc1)N(Cc1ccccc1)Cc1ccco1
InChIInChI=1S/C22H21NO2/c24-22(21-14-20(21)18-10-5-2-6-11-18)23(16-19-12-7-13-25-19)15-17-8-3-1-4-9-17/h1-13,20-21H,14-16H2
InChIKeySPPQGPTUEHJRBB-UHFFFAOYSA-N
XLogP4.61
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1S,2S)-N-benzyl-N-(furan-2-ylmethyl)-2-methylcyclopropane-1-carboxamide
CID 94823542
[4-[[furan-2-ylmethyl-(2-phenylcyclopropanecarbonyl)amino]methyl]phenyl] methanesulfonate
CID 4277765
cis-(1S,2R)-N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-2-phenyl-N-propan-2-ylcyclopropane-1-carboxamide
CID 93109865
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(2-morpholin-4-ylethyl)-2-phenylcyclopropane-1-carboxamide
CID 4145732
N-benzyl-N-(furan-2-ylmethyl)cyclopentanecarboxamide
CID 52894765
trans-(1R,2R)-N-[2-[(4-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)-2-phenylcyclopropane-1-carboxamide
CID 93110246
N-[2-[furan-2-ylmethyl(2-phenylethyl)amino]-2-oxoethyl]-N-(2-methylpropyl)-2-phenylcyclopropane-1-carboxamide
CID 3925001
cis-(1S,2R)-N-(furan-2-ylmethyl)-N-[(2-hydroxyphenyl)methyl]-2-pyridin-3-ylcyclopropane-1-carboxamide
CID 95347863
2-(furan-2-yl)-1-(2-phenylcyclopropyl)ethanone
CID 115795569
cis-(1R,2S)-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-4-yl)-2-phenylcyclopropane-1-carboxamide
CID 96998764
3-[furan-2-ylmethyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid
CID 67663893
N-benzyl-N-(furan-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 18830920

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide (CID 3873675) is N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide is O=C(C1CC1c1ccccc1)N(Cc1ccccc1)Cc1ccco1.
What is the InChIKey of N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide?
The InChIKey is SPPQGPTUEHJRBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO2/c24-22(21-14-20(21)18-10-5-2-6-11-18)23(16-19-12-7-13-25-19)15-17-8-3-1-4-9-17/h1-13,20-21H,14-16H2.
What are the key properties of N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide?
N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 4.61, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(furan-2-ylmethyl)-2-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 3873675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).