N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide

C23H22N2O3 — CID 51273057

IUPACN-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)NC2(c3ccccc3)CCC2)cc1NC(=O)c1ccco1
InChIInChI=1S/C23H22N2O3/c1-16-10-11-17(15-19(16)24-22(27)20-9-5-14-28-20)21(26)25-23(12-6-13-23)18-7-3-2-4-8-18/h2-5,7-11,14-15H,6,12-13H2,1H3,(H,24,27)(H,25,26)
InChIKeyHNMRJEOZEZYKPS-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.65
Rot. Bonds5

About N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide

N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 51273057) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID51273057
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC NameN-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccc(C(=O)NC2(c3ccccc3)CCC2)cc1NC(=O)c1ccco1
InChIInChI=1S/C23H22N2O3/c1-16-10-11-17(15-19(16)24-22(27)20-9-5-14-28-20)21(26)25-23(12-6-13-23)18-7-3-2-4-8-18/h2-5,7-11,14-15H,6,12-13H2,1H3,(H,24,27)(H,25,26)
InChIKeyHNMRJEOZEZYKPS-UHFFFAOYSA-N
XLogP4.65
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methyl-5-[(1-phenylcyclopentyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24571372
methyl 1-[[3-(furan-2-carbonylamino)-4-methylbenzoyl]amino]cyclohexane-1-carboxylate
CID 30373031
N-[5-(1,1-diphenylethylcarbamoyl)-2-methylphenyl]furan-2-carboxamide
CID 56522910
1-[[3-(furan-2-carbonylamino)-4-methylbenzoyl]-methylamino]cyclohexane-1-carboxylic acid
CID 120539605
N-[2-methyl-5-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 6459657
N-[5-[(2-amino-2-methylpropyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 119625719
N-[5-[[(2-chlorobenzoyl)amino]carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 51148221
N-[5-[(4-aminocyclohexyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 119474347
N-[2-methyl-5-[(3-oxo-3-pyrrolidin-1-ylpropyl)carbamoyl]phenyl]furan-2-carboxamide
CID 18157076
N-[5-[[(2R,4aR,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 41409796
N-[5-[(2-fluoro-4-methylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 26665761
N-[5-[(2-ethylsulfonylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 55613641

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide (CID 51273057) is N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide is Cc1ccc(C(=O)NC2(c3ccccc3)CCC2)cc1NC(=O)c1ccco1.
What is the InChIKey of N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is HNMRJEOZEZYKPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-16-10-11-17(15-19(16)24-22(27)20-9-5-14-28-20)21(26)25-23(12-6-13-23)18-7-3-2-4-8-18/h2-5,7-11,14-15H,6,12-13H2,1H3,(H,24,27)(H,25,26).
What are the key properties of N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 4.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-[(1-phenylcyclobutyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 51273057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).