5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide

C12H16N4O3 — CID 134162799

IUPAC5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide
SMILES[N-]=[N+]=NCc1ccc(C(=O)NC2CCC(O)CC2)o1
InChIInChI=1S/C12H16N4O3/c13-16-14-7-10-5-6-11(19-10)12(18)15-8-1-3-9(17)4-2-8/h5-6,8-9,17H,1-4,7H2,(H,15,18)
InChIKeyZTTGENPLUJWWRR-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.12
Rot. Bonds4

About 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide

5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide (PubChem CID 134162799) has the molecular formula C12H16N4O3 and a molecular weight of 264.28 g/mol. Its IUPAC name is 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide
PubChem CID134162799
Molecular FormulaC12H16N4O3
Molecular Weight264.28 g/mol
Exact Mass264.12
IUPAC Name5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide
SMILES[N-]=[N+]=NCc1ccc(C(=O)NC2CCC(O)CC2)o1
InChIInChI=1S/C12H16N4O3/c13-16-14-7-10-5-6-11(19-10)12(18)15-8-1-3-9(17)4-2-8/h5-6,8-9,17H,1-4,7H2,(H,15,18)
InChIKeyZTTGENPLUJWWRR-UHFFFAOYSA-N
XLogP2.12
TPSA111.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(azidomethyl)-N-[2-(1H-imidazol-5-yl)ethyl]furan-2-carboxamide
CID 134162879
5-[(2-cyanophenoxy)methyl]-N-(4-hydroxycyclohexyl)furan-2-carboxamide
CID 56814629
[5-(azidomethyl)furan-2-yl]-piperidin-1-ylmethanone
CID 134162774
5-(azidomethyl)-N-cycloheptylthiophene-2-carboxamide
CID 134162985
[5-(azidomethyl)furan-2-yl]-(2-cyclopropyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)methanone
CID 134162813
N-(2-azidoethyl)-5-ethylfuran-2-carboxamide
CID 79084209
5-ethyl-N-piperidin-4-ylfuran-2-carboxamide
CID 78981214
5-(chloromethyl)-N-[3-(cyclopropylamino)-3-oxopropyl]furan-2-carboxamide
CID 82110990
N-cyclooctyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912047
N-(4-hydroxycyclohexyl)-1,2-oxazole-5-carboxamide
CID 43389643
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-5-ethylfuran-2-carboxamide
CID 46408699
4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
CID 43393996

Frequently Asked Questions

What is the IUPAC name of 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
The IUPAC name of 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide (CID 134162799) is 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide.
What is the SMILES notation for 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
The canonical SMILES for 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide is [N-]=[N+]=NCc1ccc(C(=O)NC2CCC(O)CC2)o1.
What is the InChIKey of 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
The InChIKey is ZTTGENPLUJWWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O3/c13-16-14-7-10-5-6-11(19-10)12(18)15-8-1-3-9(17)4-2-8/h5-6,8-9,17H,1-4,7H2,(H,15,18).
What are the key properties of 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide has a molecular weight of 264.28 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azidomethyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide is sourced from PubChem (CID 134162799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).