5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide

C18H22ClN3O3 — CID 138996664

IUPAC5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide
SMILESCCc1cnc(CNC(=O)c2cnc(OC3CCCCC3)c(Cl)c2)o1
InChIInChI=1S/C18H22ClN3O3/c1-2-13-10-20-16(24-13)11-21-17(23)12-8-15(19)18(22-9-12)25-14-6-4-3-5-7-14/h8-10,14H,2-7,11H2,1H3,(H,21,23)
InChIKeyRLEVCWHNKDUMGV-UHFFFAOYSA-N
MW363.85 g/mol
LogP3.93
Rot. Bonds6

About 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide

5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 138996664) has the molecular formula C18H22ClN3O3 and a molecular weight of 363.85 g/mol. Its IUPAC name is 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide
PubChem CID138996664
Molecular FormulaC18H22ClN3O3
Molecular Weight363.85 g/mol
Exact Mass363.13
IUPAC Name5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide
SMILESCCc1cnc(CNC(=O)c2cnc(OC3CCCCC3)c(Cl)c2)o1
InChIInChI=1S/C18H22ClN3O3/c1-2-13-10-20-16(24-13)11-21-17(23)12-8-15(19)18(22-9-12)25-14-6-4-3-5-7-14/h8-10,14H,2-7,11H2,1H3,(H,21,23)
InChIKeyRLEVCWHNKDUMGV-UHFFFAOYSA-N
XLogP3.93
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.85
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-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-chloro-6-cyclohexyloxy-N-[[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]methyl]pyridine-3-carboxamide
CID 138995939
5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid
CID 16796007
4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3,5-difluorobenzamide
CID 106377037
cis-(1S,2R)-2-[(5-ethyl-1,3-oxazol-2-yl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 106370141
2-[(5-ethyl-1,3-oxazol-2-yl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 106370130
5-chloro-N-[(2-chlorophenyl)methyl]-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
CID 124891774
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidine-2-carboxamide
CID 106370890
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide
CID 106372869
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidine-4-carboxamide
CID 106371216
5-chloro-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-hydroxybenzamide
CID 104890839
3-chloro-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-(methylamino)pyridine-2-carboxamide
CID 106376888
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]azepane-1-carboxamide
CID 106370575

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide (CID 138996664) is 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide is CCc1cnc(CNC(=O)c2cnc(OC3CCCCC3)c(Cl)c2)o1.
What is the InChIKey of 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is RLEVCWHNKDUMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22ClN3O3/c1-2-13-10-20-16(24-13)11-21-17(23)12-8-15(19)18(22-9-12)25-14-6-4-3-5-7-14/h8-10,14H,2-7,11H2,1H3,(H,21,23).
What are the key properties of 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide?
5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 363.85 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-cyclohexyloxy-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 138996664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).