6-(3-ethylpiperidin-1-yl)hexan-3-ol

C13H27NO — CID 106802295

IUPAC6-(3-ethylpiperidin-1-yl)hexan-3-ol
SMILESCCC(O)CCCN1CCCC(CC)C1
InChIInChI=1S/C13H27NO/c1-3-12-7-5-9-14(11-12)10-6-8-13(15)4-2/h12-13,15H,3-11H2,1-2H3
InChIKeyXZLSQSPVDYPODO-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.66
Rot. Bonds6

About 6-(3-ethylpiperidin-1-yl)hexan-3-ol

6-(3-ethylpiperidin-1-yl)hexan-3-ol (PubChem CID 106802295) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 6-(3-ethylpiperidin-1-yl)hexan-3-ol.

Molecular Properties

Compound Name6-(3-ethylpiperidin-1-yl)hexan-3-ol
PubChem CID106802295
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name6-(3-ethylpiperidin-1-yl)hexan-3-ol
SMILESCCC(O)CCCN1CCCC(CC)C1
InChIInChI=1S/C13H27NO/c1-3-12-7-5-9-14(11-12)10-6-8-13(15)4-2/h12-13,15H,3-11H2,1-2H3
InChIKeyXZLSQSPVDYPODO-UHFFFAOYSA-N
XLogP2.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-1-heptylpiperidine
CID 171569576
6-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)hexan-3-ol
CID 106802468
6-(4-methylpiperidin-1-yl)hexan-3-ol
CID 106802233
2-[(3R)-3-ethylpiperidin-1-yl]ethanamine
CID 93187820
4-(3-ethylpiperidin-1-yl)butan-2-amine
CID 43584476
3-ethyl-1-hept-4-ynylpiperidine
CID 134581780
3-(3-ethylpiperidin-1-yl)propyl-trimethoxysilane
CID 19900960
N-[3-(3-ethylpiperidin-1-yl)propyl]cyclopropanamine
CID 60867302
1-(3-ethylpyrrolidin-1-yl)butan-2-ol
CID 115688740
N-[3-(3-ethylpiperidin-1-yl)propyl]-2-methylpropan-2-amine
CID 60851535
3-(3-ethylpiperidin-1-yl)propane-1-sulfonamide
CID 115608712
5-[3-(methoxymethyl)piperidin-1-yl]pentan-2-ol
CID 103274720

Frequently Asked Questions

What is the IUPAC name of 6-(3-ethylpiperidin-1-yl)hexan-3-ol?
The IUPAC name of 6-(3-ethylpiperidin-1-yl)hexan-3-ol (CID 106802295) is 6-(3-ethylpiperidin-1-yl)hexan-3-ol.
What is the SMILES notation for 6-(3-ethylpiperidin-1-yl)hexan-3-ol?
The canonical SMILES for 6-(3-ethylpiperidin-1-yl)hexan-3-ol is CCC(O)CCCN1CCCC(CC)C1.
What is the InChIKey of 6-(3-ethylpiperidin-1-yl)hexan-3-ol?
The InChIKey is XZLSQSPVDYPODO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-3-12-7-5-9-14(11-12)10-6-8-13(15)4-2/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 6-(3-ethylpiperidin-1-yl)hexan-3-ol?
6-(3-ethylpiperidin-1-yl)hexan-3-ol has a molecular weight of 213.36 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethylpiperidin-1-yl)hexan-3-ol is sourced from PubChem (CID 106802295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).