[1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone

C22H39N3O2 — CID 25447022

IUPAC[1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(C2CCN(CC3CCCCC3)CC2)CC1)N1CCOCC1
InChIInChI=1S/C22H39N3O2/c26-22(25-14-16-27-17-15-25)20-6-12-24(13-7-20)21-8-10-23(11-9-21)18-19-4-2-1-3-5-19/h19-21H,1-18H2
InChIKeyWVFLULFOSSPUNF-UHFFFAOYSA-N
MW377.57 g/mol
LogP2.60
Rot. Bonds4

About [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone

[1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 25447022) has the molecular formula C22H39N3O2 and a molecular weight of 377.57 g/mol. Its IUPAC name is [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID25447022
Molecular FormulaC22H39N3O2
Molecular Weight377.57 g/mol
Exact Mass377.30
IUPAC Name[1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(C2CCN(CC3CCCCC3)CC2)CC1)N1CCOCC1
InChIInChI=1S/C22H39N3O2/c26-22(25-14-16-27-17-15-25)20-6-12-24(13-7-20)21-8-10-23(11-9-21)18-19-4-2-1-3-5-19/h19-21H,1-18H2
InChIKeyWVFLULFOSSPUNF-UHFFFAOYSA-N
XLogP2.60
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.57
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone with MolForge

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Related Compounds

Cambridge id 6577508
CID 28409524
1-[4-[4-(Morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]pentan-1-one
CID 42693441
Cyclohexyl-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]methanone
CID 42693449
Cyclopropyl-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]methanone
CID 42693450
3,3-Dimethyl-1-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]butan-1-one
CID 42693454
Cyclohexyl[2-(2-morpholinoethyl)piperidino]methanone
CID 53193420
1'-(3-Cyclopentylpropyl)-4-(4-morpholinylcarbonyl)-1,4'-bipiperidine
CID 45929210
1'-[(1-Methylcyclohexyl)carbonyl]-4-(4-morpholinylcarbonyl)-1,4'-bipiperidine
CID 25375245
3-Cyclopentyl-1-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]propan-1-one
CID 26406362
Cycloheptyl-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]methanone
CID 42195314
1-(Cyclohexylmethyl)-5-{[4-(4-morpholinylmethyl)-1-piperidinyl]carbonyl}-2-piperidinone
CID 45189762
1'-[(2,2-Diethylcyclopropyl)carbonyl]-4-(4-morpholinylcarbonyl)-1,4'-bipiperidine
CID 45235446

Frequently Asked Questions

What is the IUPAC name of [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone (CID 25447022) is [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone is O=C(C1CCN(C2CCN(CC3CCCCC3)CC2)CC1)N1CCOCC1.
What is the InChIKey of [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is WVFLULFOSSPUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H39N3O2/c26-22(25-14-16-27-17-15-25)20-6-12-24(13-7-20)21-8-10-23(11-9-21)18-19-4-2-1-3-5-19/h19-21H,1-18H2.
What are the key properties of [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
[1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 377.57 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(cyclohexylmethyl)piperidin-4-yl]piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 25447022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).