N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide

C16H18N2O4 — CID 51219141

IUPACN-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide
SMILESCOCC(C)NC(=O)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C16H18N2O4/c1-11(10-21-2)17-15(19)12-5-7-13(8-6-12)18-16(20)14-4-3-9-22-14/h3-9,11H,10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyMMSIMQXHYQNDRZ-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.30
Rot. Bonds6

About N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide

N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide (PubChem CID 51219141) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide
PubChem CID51219141
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide
SMILESCOCC(C)NC(=O)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C16H18N2O4/c1-11(10-21-2)17-15(19)12-5-7-13(8-6-12)18-16(20)14-4-3-9-22-14/h3-9,11H,10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyMMSIMQXHYQNDRZ-UHFFFAOYSA-N
XLogP2.30
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-benzamido-N-(1-methoxypropan-2-yl)benzamide
CID 17153292
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
N-[4-[(4-propan-2-ylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1114254
N-[4-[1-(4-propan-2-ylphenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 55388221
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[2-[[N-(1-methoxypropan-2-yl)-N'-methylcarbamimidoyl]amino]ethyl]furan-2-carboxamide
CID 111235125
N-[4-[1-(2-chlorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 51205981
N-[4-[1-(2-bromophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 24544718
N-[4-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]phenyl]furan-2-carboxamide
CID 9152076
tert-butyl N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]carbamate
CID 45351440
N-[4-[(4-propan-2-yloxyphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 55589199
N-[4-[(2-propan-2-ylpyrazol-3-yl)carbamoyl]phenyl]furan-2-carboxamide
CID 30183964

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide (CID 51219141) is N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide is COCC(C)NC(=O)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
The InChIKey is MMSIMQXHYQNDRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-11(10-21-2)17-15(19)12-5-7-13(8-6-12)18-16(20)14-4-3-9-22-14/h3-9,11H,10H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-methoxypropan-2-ylcarbamoyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 51219141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).