N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide

C23H24N2O5 — CID 9456873

IUPACN-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccco2)c(C(=O)NC[C@H](C)c2ccccc2)cc1OC
InChIInChI=1S/C23H24N2O5/c1-15(16-8-5-4-6-9-16)14-24-22(26)17-12-20(28-2)21(29-3)13-18(17)25-23(27)19-10-7-11-30-19/h4-13,15H,14H2,1-3H3,(H,24,26)(H,25,27)/t15-/m0/s1
InChIKeyGPFKQQWQGGDHBK-HNNXBMFYSA-N
MW408.45 g/mol
LogP4.08
Rot. Bonds8

About N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide

N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 9456873) has the molecular formula C23H24N2O5 and a molecular weight of 408.45 g/mol. Its IUPAC name is N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide
PubChem CID9456873
Molecular FormulaC23H24N2O5
Molecular Weight408.45 g/mol
Exact Mass408.17
IUPAC NameN-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccco2)c(C(=O)NC[C@H](C)c2ccccc2)cc1OC
InChIInChI=1S/C23H24N2O5/c1-15(16-8-5-4-6-9-16)14-24-22(26)17-12-20(28-2)21(29-3)13-18(17)25-23(27)19-10-7-11-30-19/h4-13,15H,14H2,1-3H3,(H,24,26)(H,25,27)/t15-/m0/s1
InChIKeyGPFKQQWQGGDHBK-HNNXBMFYSA-N
XLogP4.08
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.45
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4,5-dimethoxy-2-[2-(methylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide;hydrochloride
CID 119501659
N-[2-(2-chlorobenzoyl)-4,5-dimethoxyphenyl]furan-2-carboxamide
CID 2989497
N-[4,5-dimethoxy-2-(pyrrolidin-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 119511764
2-hydroxyethyl 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate
CID 24530674
[2-oxo-2-(4-propan-2-ylphenyl)ethyl] 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate
CID 16534409
[2-(carbamoylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate
CID 16534373
N-(2-methoxy-5-propan-2-ylphenyl)furan-2-carboxamide
CID 110776781
N-[2-(1-aminohexan-2-ylcarbamoyl)-4,5-dimethoxyphenyl]furan-2-carboxamide
CID 119666392
N-[4,5-dimethoxy-2-[[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]carbamoyl]phenyl]furan-2-carboxamide
CID 154748220
2,5-dimethoxy-N-[(2R)-2-phenylpropyl]benzamide
CID 8624150
N-[2,5-dimethoxy-4-(2-methoxyethylcarbamothioylamino)phenyl]furan-2-carboxamide
CID 3169047
N-[2-(3,4-dimethoxyphenyl)-3-methylbutyl]furan-2-carboxamide
CID 110314871

Frequently Asked Questions

What is the IUPAC name of N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide (CID 9456873) is N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide is COc1cc(NC(=O)c2ccco2)c(C(=O)NC[C@H](C)c2ccccc2)cc1OC.
What is the InChIKey of N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is GPFKQQWQGGDHBK-HNNXBMFYSA-N. The full InChI is InChI=1S/C23H24N2O5/c1-15(16-8-5-4-6-9-16)14-24-22(26)17-12-20(28-2)21(29-3)13-18(17)25-23(27)19-10-7-11-30-19/h4-13,15H,14H2,1-3H3,(H,24,26)(H,25,27)/t15-/m0/s1.
What are the key properties of N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide?
N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 408.45 g/mol, XLogP of 4.08, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4,5-dimethoxy-2-[[(2R)-2-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 9456873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).