3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol

C16H31NO2 — CID 79060616

IUPAC3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol
SMILESCCCC(C)CC(O)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C16H31NO2/c1-3-6-14(2)13-15(18)16(7-4-5-8-16)17-9-11-19-12-10-17/h14-15,18H,3-13H2,1-2H3
InChIKeyGYNPULOVKVQLTI-UHFFFAOYSA-N
MW269.43 g/mol
LogP2.82
Rot. Bonds6

About 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol

3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol (PubChem CID 79060616) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol.

Molecular Properties

Compound Name3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol
PubChem CID79060616
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC Name3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol
SMILESCCCC(C)CC(O)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C16H31NO2/c1-3-6-14(2)13-15(18)16(7-4-5-8-16)17-9-11-19-12-10-17/h14-15,18H,3-13H2,1-2H3
InChIKeyGYNPULOVKVQLTI-UHFFFAOYSA-N
XLogP2.82
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol?
The IUPAC name of 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol (CID 79060616) is 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol.
What is the SMILES notation for 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol?
The canonical SMILES for 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol is CCCC(C)CC(O)C1(N2CCOCC2)CCCC1.
What is the InChIKey of 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol?
The InChIKey is GYNPULOVKVQLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-3-6-14(2)13-15(18)16(7-4-5-8-16)17-9-11-19-12-10-17/h14-15,18H,3-13H2,1-2H3.
What are the key properties of 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol?
3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol has a molecular weight of 269.43 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol is sourced from PubChem (CID 79060616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).