(3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide

C16H27N5O4 — CID 10291655

IUPAC(3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide
SMILESNC(=O)NCc1noc(C(CCCC2CCCCC2)CC(=O)NO)n1
InChIInChI=1S/C16H27N5O4/c17-16(23)18-10-13-19-15(25-21-13)12(9-14(22)20-24)8-4-7-11-5-2-1-3-6-11/h11-12,24H,1-10H2,(H,20,22)(H3,17,18,23)
InChIKeyHKJAZOFDJVASPW-UHFFFAOYSA-N
MW353.42 g/mol
LogP1.97
Rot. Bonds9

About (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide

(3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide (PubChem CID 10291655) has the molecular formula C16H27N5O4 and a molecular weight of 353.42 g/mol. Its IUPAC name is (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide.

Molecular Properties

Compound Name(3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide
PubChem CID10291655
Molecular FormulaC16H27N5O4
Molecular Weight353.42 g/mol
Exact Mass353.21
IUPAC Name(3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide
SMILESNC(=O)NCc1noc(C(CCCC2CCCCC2)CC(=O)NO)n1
InChIInChI=1S/C16H27N5O4/c17-16(23)18-10-13-19-15(25-21-13)12(9-14(22)20-24)8-4-7-11-5-2-1-3-6-11/h11-12,24H,1-10H2,(H,20,22)(H3,17,18,23)
InChIKeyHKJAZOFDJVASPW-UHFFFAOYSA-N
XLogP1.97
TPSA143.37 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 51.97
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide?
The IUPAC name of (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide (CID 10291655) is (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide.
What is the SMILES notation for (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide?
The canonical SMILES for (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide is NC(=O)NCc1noc(C(CCCC2CCCCC2)CC(=O)NO)n1.
What is the InChIKey of (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide?
The InChIKey is HKJAZOFDJVASPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O4/c17-16(23)18-10-13-19-15(25-21-13)12(9-14(22)20-24)8-4-7-11-5-2-1-3-6-11/h11-12,24H,1-10H2,(H,20,22)(H3,17,18,23).
What are the key properties of (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide?
(3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide has a molecular weight of 353.42 g/mol, XLogP of 1.97, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[3-[(carbamoylamino)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-N-hydroxyhexanamide is sourced from PubChem (CID 10291655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).