1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide

C20H26N4O3 — CID 118791034

IUPAC1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide
SMILESO=C(NCc1ccc(-c2ncon2)cc1)C1(N2CCOCC2)CCCCC1
InChIInChI=1S/C20H26N4O3/c25-19(20(8-2-1-3-9-20)24-10-12-26-13-11-24)21-14-16-4-6-17(7-5-16)18-22-15-27-23-18/h4-7,15H,1-3,8-14H2,(H,21,25)
InChIKeyOZYUXVOXHJGQBL-UHFFFAOYSA-N
MW370.45 g/mol
LogP2.39
Rot. Bonds5

About 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide

1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide (PubChem CID 118791034) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide
PubChem CID118791034
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC Name1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide
SMILESO=C(NCc1ccc(-c2ncon2)cc1)C1(N2CCOCC2)CCCCC1
InChIInChI=1S/C20H26N4O3/c25-19(20(8-2-1-3-9-20)24-10-12-26-13-11-24)21-14-16-4-6-17(7-5-16)18-22-15-27-23-18/h4-7,15H,1-3,8-14H2,(H,21,25)
InChIKeyOZYUXVOXHJGQBL-UHFFFAOYSA-N
XLogP2.39
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
CID 90652941
1-morpholin-4-yl-N-[(5-phenylfuran-2-yl)methyl]cyclohexane-1-carboxamide
CID 118766127
N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]-3-(2-oxoazepan-1-yl)propanamide
CID 118773460
1-morpholin-4-yl-N-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]cyclobutane-1-carboxamide
CID 136522349
N-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-1-morpholin-4-ylcyclohexane-1-carboxamide
CID 91765118
1-morpholin-4-yl-N-(3-pyridin-3-yloxypropyl)cyclohexane-1-carboxamide
CID 118774806
(3S)-1-cyclopentyl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 125163304
N-[3-[(5-methyl-2-pyridinyl)amino]propyl]-1-morpholin-4-ylcyclopentane-1-carboxamide
CID 86778769
N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 118780237
1-amino-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119846317
(1S,3R,4R)-3-amino-4-hydroxy-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide
CID 155492230
N-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]methyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
CID 91836336

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide?
The IUPAC name of 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide (CID 118791034) is 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide?
The canonical SMILES for 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide is O=C(NCc1ccc(-c2ncon2)cc1)C1(N2CCOCC2)CCCCC1.
What is the InChIKey of 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide?
The InChIKey is OZYUXVOXHJGQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c25-19(20(8-2-1-3-9-20)24-10-12-26-13-11-24)21-14-16-4-6-17(7-5-16)18-22-15-27-23-18/h4-7,15H,1-3,8-14H2,(H,21,25).
What are the key properties of 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide?
1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 118791034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).