N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide

C19H36N2O2 — CID 134015029

IUPACN-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide
SMILESCCCCCCCC(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C19H36N2O2/c1-2-3-4-5-7-10-18(22)20-17-19(11-8-6-9-12-19)21-13-15-23-16-14-21/h2-17H2,1H3,(H,20,22)
InChIKeySFYGBGHWJYRWQF-UHFFFAOYSA-N
MW324.51 g/mol
LogP3.50
Rot. Bonds9

About N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide

N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide (PubChem CID 134015029) has the molecular formula C19H36N2O2 and a molecular weight of 324.51 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide
PubChem CID134015029
Molecular FormulaC19H36N2O2
Molecular Weight324.51 g/mol
Exact Mass324.28
IUPAC NameN-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide
SMILESCCCCCCCC(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C19H36N2O2/c1-2-3-4-5-7-10-18(22)20-17-19(11-8-6-9-12-19)21-13-15-23-16-14-21/h2-17H2,1H3,(H,20,22)
InChIKeySFYGBGHWJYRWQF-UHFFFAOYSA-N
XLogP3.50
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.51
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(1-methyl-4-morpholin-4-ylpiperidin-4-yl)methyl]pentanamide
CID 112505002
3,3-dimethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
CID 78789271
2-[butyl-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]amino]acetamide
CID 55700066
2-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
CID 78789816
4-(methylamino)-N-[(1-piperidin-1-ylcyclohexyl)methyl]butanamide
CID 61249197
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide
CID 18150652
4-butyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]cyclohexane-1-carboxamide;hydrochloride
CID 20995034
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide
CID 131914905
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 51223648
1-ethyl-3-[(1-morpholin-4-ylcyclohexyl)methyl]thiourea
CID 8788201
N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]cyclohexanecarboxamide
CID 17459032
N-[[1-(chloromethyl)cyclohexyl]methyl]decanamide
CID 103969577

Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide (CID 134015029) is N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide is CCCCCCCC(=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide?
The InChIKey is SFYGBGHWJYRWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2O2/c1-2-3-4-5-7-10-18(22)20-17-19(11-8-6-9-12-19)21-13-15-23-16-14-21/h2-17H2,1H3,(H,20,22).
What are the key properties of N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide?
N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide has a molecular weight of 324.51 g/mol, XLogP of 3.50, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide is sourced from PubChem (CID 134015029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).