N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide

C17H25N3O3 — CID 656103

IUPACN-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide
SMILESO=C(NC1CCN(C(=O)NC2CCCCC2)CC1)c1ccco1
InChIInChI=1S/C17H25N3O3/c21-16(15-7-4-12-23-15)18-14-8-10-20(11-9-14)17(22)19-13-5-2-1-3-6-13/h4,7,12-14H,1-3,5-6,8-11H2,(H,18,21)(H,19,22)
InChIKeyHAPIGDQRNYDFIY-UHFFFAOYSA-N
MW319.40 g/mol
LogP2.52
Rot. Bonds3

About N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide

N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide (PubChem CID 656103) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide
PubChem CID656103
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC NameN-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide
SMILESO=C(NC1CCN(C(=O)NC2CCCCC2)CC1)c1ccco1
InChIInChI=1S/C17H25N3O3/c21-16(15-7-4-12-23-15)18-14-8-10-20(11-9-14)17(22)19-13-5-2-1-3-6-13/h4,7,12-14H,1-3,5-6,8-11H2,(H,18,21)(H,19,22)
InChIKeyHAPIGDQRNYDFIY-UHFFFAOYSA-N
XLogP2.52
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide (CID 656103) is N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide is O=C(NC1CCN(C(=O)NC2CCCCC2)CC1)c1ccco1.
What is the InChIKey of N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide?
The InChIKey is HAPIGDQRNYDFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c21-16(15-7-4-12-23-15)18-14-8-10-20(11-9-14)17(22)19-13-5-2-1-3-6-13/h4,7,12-14H,1-3,5-6,8-11H2,(H,18,21)(H,19,22).
What are the key properties of N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide?
N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide has a molecular weight of 319.40 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(furan-2-carbonylamino)piperidine-1-carboxamide is sourced from PubChem (CID 656103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).