(1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide

C17H22N2O3 — CID 30746655

IUPAC(1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide
SMILESO=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1CC=CCC1
InChIInChI=1S/C17H22N2O3/c20-16(13-4-2-1-3-5-13)18-15-6-9-19(10-7-15)17(21)14-8-11-22-12-14/h1-2,8,11-13,15H,3-7,9-10H2,(H,18,20)/t13-/m0/s1
InChIKeyXSVLWXGFAGEIKW-ZDUSSCGKSA-N
MW302.37 g/mol
LogP2.36
Rot. Bonds3

About (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide

(1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide (PubChem CID 30746655) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide.

Molecular Properties

Compound Name(1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide
PubChem CID30746655
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name(1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide
SMILESO=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1CC=CCC1
InChIInChI=1S/C17H22N2O3/c20-16(13-4-2-1-3-5-13)18-15-6-9-19(10-7-15)17(21)14-8-11-22-12-14/h1-2,8,11-13,15H,3-7,9-10H2,(H,18,20)/t13-/m0/s1
InChIKeyXSVLWXGFAGEIKW-ZDUSSCGKSA-N
XLogP2.36
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[1-(furan-3-carbonyl)piperidin-4-yl]-1-methylsulfonylpiperidine-4-carboxamide
CID 30711489
2-[[1-(furan-3-carbonyl)piperidin-4-yl]carbamoyl]cyclopropane-1-carboxylic acid
CID 119180130
(2R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]oxolane-2-carboxamide
CID 38197318
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-methylpropanamide
CID 38198075
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-(4-methylphenyl)-2-oxoacetamide
CID 38216371
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide
CID 46477305
ethyl 3-[[1-(furan-3-carbonyl)piperidin-4-yl]carbamoyl]piperidine-1-carboxylate
CID 43057335
2-ethyl-N-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-1-carboxamide
CID 87003503
2-(2,6-dichlorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]acetamide
CID 38198477
5-bromo-N-[1-(furan-3-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 38198333
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-methylbenzamide
CID 38207852
N-(1-propan-2-ylpiperidin-4-yl)cyclohex-3-ene-1-carboxamide
CID 42891784

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide?
The IUPAC name of (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide (CID 30746655) is (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide.
What is the SMILES notation for (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide?
The canonical SMILES for (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide is O=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1CC=CCC1.
What is the InChIKey of (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide?
The InChIKey is XSVLWXGFAGEIKW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H22N2O3/c20-16(13-4-2-1-3-5-13)18-15-6-9-19(10-7-15)17(21)14-8-11-22-12-14/h1-2,8,11-13,15H,3-7,9-10H2,(H,18,20)/t13-/m0/s1.
What are the key properties of (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide?
(1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide has a molecular weight of 302.37 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[1-(furan-3-carbonyl)piperidin-4-yl]cyclohex-3-ene-1-carboxamide is sourced from PubChem (CID 30746655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).