N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide

C15H22N2O2 — CID 831804

IUPACN-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide
SMILESCC(C)(C)C1CCC(=NNC(=O)c2ccco2)CC1
InChIInChI=1S/C15H22N2O2/c1-15(2,3)11-6-8-12(9-7-11)16-17-14(18)13-5-4-10-19-13/h4-5,10-11H,6-9H2,1-3H3,(H,17,18)/b16-12-
InChIKeyAKSSLUXCSVHFQG-VBKFSLOCSA-N
MW262.35 g/mol
LogP3.60
Rot. Bonds2

About N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide

N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide (PubChem CID 831804) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide
PubChem CID831804
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide
SMILESCC(C)(C)C1CCC(=NNC(=O)c2ccco2)CC1
InChIInChI=1S/C15H22N2O2/c1-15(2,3)11-6-8-12(9-7-11)16-17-14(18)13-5-4-10-19-13/h4-5,10-11H,6-9H2,1-3H3,(H,17,18)/b16-12-
InChIKeyAKSSLUXCSVHFQG-VBKFSLOCSA-N
XLogP3.60
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[(E)-phenylmethylidene]furan-2-carbohydrazide
CID 6869164
N-[(E)-1-(4-phenylphenyl)ethylideneamino]furan-2-carboxamide
CID 9615835
N'-[(1E)-6-methoxy-3-methyl-3,4-dihydronaphthalen-1(2H)-ylidene]-2-furohydrazide
CID 9599633
N-[(E)-(4-methylphenyl)methylideneamino]furan-2-carboxamide
CID 6870919
N'-(1-ethyl-4-piperidinylidene)-2-furohydrazide
CID 840590
N'-[(1E,2E)-2-methyl-3-phenylprop-2-enylidene]-2-furohydrazide
CID 9613794
5-bromo-N'-(1-phenylpentylidene)-2-furohydrazide
CID 9632133
N-(tert-butyl)-3-(2-furoylhydrazono)butanamide
CID 5822222
N'-(bicyclo[2.2.1]hept-2-ylmethylene)-2-furohydrazide
CID 9675460
N'-(adamantane-1-carbonyl)furan-2-carbohydrazide
CID 2850517
CID 16193431
CID 16193431
2-[2-(4-tert-butylcyclohexylidene)hydrazino]-N-(2-furylmethyl)-2-oxoacetamide
CID 2875468

Frequently Asked Questions

What is the IUPAC name of N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide?
The IUPAC name of N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide (CID 831804) is N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide.
What is the SMILES notation for N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide?
The canonical SMILES for N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide is CC(C)(C)C1CCC(=NNC(=O)c2ccco2)CC1.
What is the InChIKey of N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide?
The InChIKey is AKSSLUXCSVHFQG-VBKFSLOCSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-15(2,3)11-6-8-12(9-7-11)16-17-14(18)13-5-4-10-19-13/h4-5,10-11H,6-9H2,1-3H3,(H,17,18)/b16-12-.
What are the key properties of N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide?
N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-tert-butylcyclohexylidene)amino]furan-2-carboxamide is sourced from PubChem (CID 831804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).