(3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide

C19H26N4O3 — CID 10109052

IUPAC(3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide
SMILESO=C(C[C@@H](CCCC1CCCCC1)c1nc(-c2cccnc2)no1)NO
InChIInChI=1S/C19H26N4O3/c24-17(22-25)12-15(9-4-8-14-6-2-1-3-7-14)19-21-18(23-26-19)16-10-5-11-20-13-16/h5,10-11,13-15,25H,1-4,6-9,12H2,(H,22,24)/t15-/m1/s1
InChIKeySITLCQPORCSLQV-OAHLLOKOSA-N
MW358.44 g/mol
LogP3.86
Rot. Bonds8

About (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide

(3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide (PubChem CID 10109052) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide.

Molecular Properties

Compound Name(3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide
PubChem CID10109052
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name(3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide
SMILESO=C(C[C@@H](CCCC1CCCCC1)c1nc(-c2cccnc2)no1)NO
InChIInChI=1S/C19H26N4O3/c24-17(22-25)12-15(9-4-8-14-6-2-1-3-7-14)19-21-18(23-26-19)16-10-5-11-20-13-16/h5,10-11,13-15,25H,1-4,6-9,12H2,(H,22,24)/t15-/m1/s1
InChIKeySITLCQPORCSLQV-OAHLLOKOSA-N
XLogP3.86
TPSA101.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 53.86
H-Bond Donors ≤ 52
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'}

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Frequently Asked Questions

What is the IUPAC name of (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide?
The IUPAC name of (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide (CID 10109052) is (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide.
What is the SMILES notation for (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide?
The canonical SMILES for (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide is O=C(C[C@@H](CCCC1CCCCC1)c1nc(-c2cccnc2)no1)NO.
What is the InChIKey of (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide?
The InChIKey is SITLCQPORCSLQV-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H26N4O3/c24-17(22-25)12-15(9-4-8-14-6-2-1-3-7-14)19-21-18(23-26-19)16-10-5-11-20-13-16/h5,10-11,13-15,25H,1-4,6-9,12H2,(H,22,24)/t15-/m1/s1.
What are the key properties of (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide?
(3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide has a molecular weight of 358.44 g/mol, XLogP of 3.86, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-6-cyclohexyl-N-hydroxy-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hexanamide is sourced from PubChem (CID 10109052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).