2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile

C17H18N2O — CID 82487040

IUPAC2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile
SMILESN#Cc1c(-c2ccc(C3CCCCC3)cc2)coc1N
InChIInChI=1S/C17H18N2O/c18-10-15-16(11-20-17(15)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,11-12H,1-5,19H2
InChIKeyWZIGEEGJBZYIEW-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.45
Rot. Bonds2

About 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile

2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile (PubChem CID 82487040) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile
PubChem CID82487040
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile
SMILESN#Cc1c(-c2ccc(C3CCCCC3)cc2)coc1N
InChIInChI=1S/C17H18N2O/c18-10-15-16(11-20-17(15)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,11-12H,1-5,19H2
InChIKeyWZIGEEGJBZYIEW-UHFFFAOYSA-N
XLogP4.45
TPSA62.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-amino-4-(4-butoxyphenyl)furan-3-carbonitrile
CID 96664729
1-cyclohexyl-4-(4-cyclohexylphenyl)benzene;hydrogen peroxide
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4-chloro-2-(4-cyclohexylphenyl)aniline
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4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine
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1-cyclopentyl-4-(4-cyclopentylphenyl)benzene;hydrogen peroxide
CID 175056737
1-cyclohexyl-4-(4-methylphenyl)benzene
CID 54213441
4-bromo-5-(4-cyclohexylphenyl)-1,2-oxazole-3-carbonitrile
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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile?
The IUPAC name of 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile (CID 82487040) is 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile?
The canonical SMILES for 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile is N#Cc1c(-c2ccc(C3CCCCC3)cc2)coc1N.
What is the InChIKey of 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile?
The InChIKey is WZIGEEGJBZYIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c18-10-15-16(11-20-17(15)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,11-12H,1-5,19H2.
What are the key properties of 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile?
2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile has a molecular weight of 266.34 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-cyclohexylphenyl)furan-3-carbonitrile is sourced from PubChem (CID 82487040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).