1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol

C14H28N2O2 — CID 60899322

IUPAC1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol
SMILESOC1(CNCCCN2CCOCC2)CCCCC1
InChIInChI=1S/C14H28N2O2/c17-14(5-2-1-3-6-14)13-15-7-4-8-16-9-11-18-12-10-16/h15,17H,1-13H2
InChIKeyHIXNQMXFJLEIHQ-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.99
Rot. Bonds6

About 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol

1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol (PubChem CID 60899322) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol
PubChem CID60899322
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol
SMILESOC1(CNCCCN2CCOCC2)CCCCC1
InChIInChI=1S/C14H28N2O2/c17-14(5-2-1-3-6-14)13-15-7-4-8-16-9-11-18-12-10-16/h15,17H,1-13H2
InChIKeyHIXNQMXFJLEIHQ-UHFFFAOYSA-N
XLogP0.99
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[(2-thiomorpholin-4-ylethylamino)methyl]cycloheptan-1-ol
CID 106325299
4-(3-morpholin-4-ylpropylamino)butanenitrile
CID 43236907
1-[(4-hydroxybutylamino)methyl]cycloheptan-1-ol
CID 65122781
1-(3-morpholin-4-ylpropyl)cyclopropan-1-ol
CID 115073591
5-(3-morpholin-4-ylpropylamino)pentan-1-ol
CID 62227528
ethane;N-ethyl-3-morpholin-4-ylpropan-1-amine
CID 170595450
N-(3-morpholin-4-ylpropyl)but-2-yn-1-amine
CID 62309941
N-[(1-hydroxycyclopentyl)methyl]-2-morpholin-4-ylacetamide
CID 110011664
N-[2-(1-methoxycyclobutyl)ethyl]-3-morpholin-4-ylpropan-1-amine
CID 103556603
1-[(4-hydroxybutylamino)methyl]cyclopentan-1-ol
CID 65108735
1-[(octylamino)methyl]cyclohexan-1-ol
CID 65106974
5-[(1-hydroxycycloheptyl)methylamino]pentanenitrile
CID 65123008

Frequently Asked Questions

What is the IUPAC name of 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol (CID 60899322) is 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol is OC1(CNCCCN2CCOCC2)CCCCC1.
What is the InChIKey of 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol?
The InChIKey is HIXNQMXFJLEIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c17-14(5-2-1-3-6-14)13-15-7-4-8-16-9-11-18-12-10-16/h15,17H,1-13H2.
What are the key properties of 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol?
1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol has a molecular weight of 256.39 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-morpholin-4-ylpropylamino)methyl]cyclohexan-1-ol is sourced from PubChem (CID 60899322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).