[1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol

C13H25NO — CID 169177357

IUPAC[1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol
SMILESC=C(CCC(C)C)N1CCCC(CO)C1
InChIInChI=1S/C13H25NO/c1-11(2)6-7-12(3)14-8-4-5-13(9-14)10-15/h11,13,15H,3-10H2,1-2H3
InChIKeyVXFALWQDAJMYEF-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.64
Rot. Bonds5

About [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol

[1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol (PubChem CID 169177357) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol
PubChem CID169177357
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name[1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol
SMILESC=C(CCC(C)C)N1CCCC(CO)C1
InChIInChI=1S/C13H25NO/c1-11(2)6-7-12(3)14-8-4-5-13(9-14)10-15/h11,13,15H,3-10H2,1-2H3
InChIKeyVXFALWQDAJMYEF-UHFFFAOYSA-N
XLogP2.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(4E)-1-ethyl-4-(fluoromethylidene)piperidin-3-yl]methanol
CID 177009915
(6-Methylidenepiperidin-3-yl)methanol
CID 68263787
1-Ethyl-2,2-dimethyl-6-methylidenepiperidin-4-ol
CID 68390746
(5-Methyl-1-prop-1-en-2-ylpiperidin-3-yl)methanol
CID 141835949
5-[Ethyl(pentyl)amino]hex-5-en-1-ol
CID 146558005
2-(1-Prop-1-en-2-ylpiperidin-4-yl)ethanol
CID 147010900
(1-Prop-1-en-2-ylpiperidin-3-yl)methanol
CID 154986403
(1S)-1-[(3S)-1-prop-1-en-2-ylpiperidin-3-yl]ethanol
CID 156651642
1-(1-Tert-butylpiperidin-3-yl)ethenol
CID 160773907
(2S)-1-ethyl-2,4-dimethyl-6-methylidenepiperidin-2-ol
CID 166857052
(4-Ethenyl-1-methylpiperidin-3-yl)methanol
CID 166946029
N-ethyl-N-methyl-1-(oxan-3-yl)ethenamine
CID 175613041

Frequently Asked Questions

What is the IUPAC name of [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol?
The IUPAC name of [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol (CID 169177357) is [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol is C=C(CCC(C)C)N1CCCC(CO)C1.
What is the InChIKey of [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol?
The InChIKey is VXFALWQDAJMYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11(2)6-7-12(3)14-8-4-5-13(9-14)10-15/h11,13,15H,3-10H2,1-2H3.
What are the key properties of [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol?
[1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol has a molecular weight of 211.35 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methylhex-1-en-2-yl)piperidin-3-yl]methanol is sourced from PubChem (CID 169177357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).