N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide

C23H25NO3 — CID 19461005

IUPACN-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1ccc(COc2ccc3ccccc3c2)o1
InChIInChI=1S/C23H25NO3/c25-23(24-19-9-3-1-2-4-10-19)22-14-13-21(27-22)16-26-20-12-11-17-7-5-6-8-18(17)15-20/h5-8,11-15,19H,1-4,9-10,16H2,(H,24,25)
InChIKeyISJKUFGCZLHONW-UHFFFAOYSA-N
MW363.46 g/mol
LogP5.46
Rot. Bonds5

About N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide

N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide (PubChem CID 19461005) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
PubChem CID19461005
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC NameN-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1ccc(COc2ccc3ccccc3c2)o1
InChIInChI=1S/C23H25NO3/c25-23(24-19-9-3-1-2-4-10-19)22-14-13-21(27-22)16-26-20-12-11-17-7-5-6-8-18(17)15-20/h5-8,11-15,19H,1-4,9-10,16H2,(H,24,25)
InChIKeyISJKUFGCZLHONW-UHFFFAOYSA-N
XLogP5.46
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
N-cycloheptyl-5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carboxamide
CID 19458831
N-cycloheptyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 1011914
N-[1-(furan-3-carbonyl)piperidin-4-yl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 38025161
5-[(4-tert-butylphenoxy)methyl]-N-cyclohexylfuran-2-carboxamide
CID 998142
methyl 4-[[5-(cyclododecylcarbamoyl)furan-2-yl]methoxy]benzoate
CID 17024109
5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
CID 19455175
N-cyclooctyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912047
N-(2-hydroxyphenyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460984
N-cyclopropyl-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19446522
5-[[4-(cyclohexylcarbamoyl)phenoxy]methyl]furan-2-carboxylic acid
CID 22683768
[5-(naphthalen-2-yloxymethyl)furan-2-yl]-piperidin-1-ylmethanone
CID 19579214

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
The IUPAC name of N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide (CID 19461005) is N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
The canonical SMILES for N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide is O=C(NC1CCCCCC1)c1ccc(COc2ccc3ccccc3c2)o1.
What is the InChIKey of N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
The InChIKey is ISJKUFGCZLHONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c25-23(24-19-9-3-1-2-4-10-19)22-14-13-21(27-22)16-26-20-12-11-17-7-5-6-8-18(17)15-20/h5-8,11-15,19H,1-4,9-10,16H2,(H,24,25).
What are the key properties of N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide has a molecular weight of 363.46 g/mol, XLogP of 5.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide is sourced from PubChem (CID 19461005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).