N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide

C20H25NO2 — CID 3532483

IUPACN-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide
SMILESO=C(CC(Cc1ccccc1)c1ccco1)NC1CCCCC1
InChIInChI=1S/C20H25NO2/c22-20(21-18-10-5-2-6-11-18)15-17(19-12-7-13-23-19)14-16-8-3-1-4-9-16/h1,3-4,7-9,12-13,17-18H,2,5-6,10-11,14-15H2,(H,21,22)
InChIKeyWHIGIKAAMNRNEB-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.44
Rot. Bonds6

About N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide

N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide (PubChem CID 3532483) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide
PubChem CID3532483
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC NameN-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide
SMILESO=C(CC(Cc1ccccc1)c1ccco1)NC1CCCCC1
InChIInChI=1S/C20H25NO2/c22-20(21-18-10-5-2-6-11-18)15-17(19-12-7-13-23-19)14-16-8-3-1-4-9-16/h1,3-4,7-9,12-13,17-18H,2,5-6,10-11,14-15H2,(H,21,22)
InChIKeyWHIGIKAAMNRNEB-UHFFFAOYSA-N
XLogP4.44
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2E)-3-(furan-2-yl)-N-(2-phenylethyl)prop-2-enamide
CID 790283
(2S)-1-[(2S)-2-amino-3-[4-(furan-2-yl)phenyl]propanoyl]pyrrolidine-2-carbonitrile
CID 23645378
N-Benzyl-3-(5-methyl-furan-2-yl)-propionamide
CID 827173
3-Furan-2-yl-N-[2-(4-methoxy-phenyl)-ethyl]-acrylamide
CID 963760
3-ethoxy-N-(2-methyl-1-phenylpropyl)benzamide
CID 2974778
N-(1-Benzyl-propyl)-3-furan-2-yl-acrylamide
CID 5762726
Methyl 2-[3-(furan-2-yl)propanoylamino]-3-(4-hydroxyphenyl)propanoate
CID 16331467
3-(Furan-2-yl)-3-(p-tolyl)propan-1-amine
CID 2771861
2-methyl-N-(4-phenylbutan-2-yl)furan-3-carboxamide
CID 2933467
3-(4-fluorophenyl)-3-(furan-2-yl)-N,N-dipropylpropanamide
CID 661862
(7S,8R,11S)-11-benzoyl-N-hydroxy-8-(2-methylpropyl)-9-oxo-2-oxa-10-azabicyclo[11.2.2]heptadeca-1(15),13,16-triene-7-carboxamide
CID 44339536
3-(furan-2-yl)-4-phenyl-N-(1-phenylethyl)butan-1-amine
CID 2954718

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide?
The IUPAC name of N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide (CID 3532483) is N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide.
What is the SMILES notation for N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide?
The canonical SMILES for N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide is O=C(CC(Cc1ccccc1)c1ccco1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide?
The InChIKey is WHIGIKAAMNRNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c22-20(21-18-10-5-2-6-11-18)15-17(19-12-7-13-23-19)14-16-8-3-1-4-9-16/h1,3-4,7-9,12-13,17-18H,2,5-6,10-11,14-15H2,(H,21,22).
What are the key properties of N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide?
N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide has a molecular weight of 311.43 g/mol, XLogP of 4.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(furan-2-yl)-4-phenylbutanamide is sourced from PubChem (CID 3532483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).