N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide

C20H19N3O4 — CID 38205484

IUPACN-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide
SMILESCOc1cccc(CNC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)c1
InChIInChI=1S/C20H19N3O4/c1-26-17-5-2-4-14(12-17)13-21-20(25)23-16-9-7-15(8-10-16)22-19(24)18-6-3-11-27-18/h2-12H,13H2,1H3,(H,22,24)(H2,21,23,25)
InChIKeyHHPXVXSAYWREQK-UHFFFAOYSA-N
MW365.39 g/mol
LogP3.86
Rot. Bonds6

About N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide

N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide (PubChem CID 38205484) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide
PubChem CID38205484
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC NameN-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide
SMILESCOc1cccc(CNC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)c1
InChIInChI=1S/C20H19N3O4/c1-26-17-5-2-4-14(12-17)13-21-20(25)23-16-9-7-15(8-10-16)22-19(24)18-6-3-11-27-18/h2-12H,13H2,1H3,(H,22,24)(H2,21,23,25)
InChIKeyHHPXVXSAYWREQK-UHFFFAOYSA-N
XLogP3.86
TPSA92.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 53.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[3-(3-methoxyphenyl)propanoylamino]methyl]phenyl]furan-2-carboxamide
CID 24618608
N-[2-[(3-methoxyphenyl)methylcarbamoylamino]ethyl]furan-2-carboxamide
CID 36505080
N-[4-[(3-methoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 780805
N-[3-[[(3-ethoxyphenyl)carbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 87010587
N-[3-[(naphthalen-2-ylcarbamoylamino)methyl]phenyl]furan-2-carboxamide
CID 78871658
N-[4-[[[N-ethyl-N'-[(3-methoxyphenyl)methyl]carbamimidoyl]amino]methyl]phenyl]furan-2-carboxamide;hydroiodide
CID 111249878
1-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(3-methoxyphenyl)urea
CID 55684243
N-[3-[[(3-pyridin-4-yloxyphenyl)carbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 86940328
N-[4-[[(3-bromo-4-methylphenyl)carbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 78870406
N-[4-[3-(3,5-dimethoxyphenyl)propanoylamino]phenyl]furan-2-carboxamide
CID 42014719
N-[3-[(3-methylbut-2-enylcarbamoylamino)methyl]phenyl]furan-2-carboxamide
CID 100700674
N-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]phenyl]furan-2-carboxamide
CID 32521036

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide (CID 38205484) is N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide is COc1cccc(CNC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)c1.
What is the InChIKey of N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide?
The InChIKey is HHPXVXSAYWREQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-26-17-5-2-4-14(12-17)13-21-20(25)23-16-9-7-15(8-10-16)22-19(24)18-6-3-11-27-18/h2-12H,13H2,1H3,(H,22,24)(H2,21,23,25).
What are the key properties of N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide?
N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 3.86, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-methoxyphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 38205484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).