1-(3-methylbut-1-en-2-yl)piperidin-4-ol

C10H19NO — CID 142588017

IUPAC1-(3-methylbut-1-en-2-yl)piperidin-4-ol
SMILESC=C(C(C)C)N1CCC(O)CC1
InChIInChI=1S/C10H19NO/c1-8(2)9(3)11-6-4-10(12)5-7-11/h8,10,12H,3-7H2,1-2H3
InChIKeyBXIUWWWRGZWHIW-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.61
Rot. Bonds2

About 1-(3-methylbut-1-en-2-yl)piperidin-4-ol

1-(3-methylbut-1-en-2-yl)piperidin-4-ol (PubChem CID 142588017) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(3-methylbut-1-en-2-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-methylbut-1-en-2-yl)piperidin-4-ol
PubChem CID142588017
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(3-methylbut-1-en-2-yl)piperidin-4-ol
SMILESC=C(C(C)C)N1CCC(O)CC1
InChIInChI=1S/C10H19NO/c1-8(2)9(3)11-6-4-10(12)5-7-11/h8,10,12H,3-7H2,1-2H3
InChIKeyBXIUWWWRGZWHIW-UHFFFAOYSA-N
XLogP1.61
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethyl-2,2-dimethyl-6-methylidenepiperidin-4-ol
CID 68390746
1-Prop-1-en-2-ylpiperidin-4-ol
CID 70214010
4-Piperidin-1-ylpent-4-en-2-ol
CID 70538591
4-Methoxy-1-(3-methylbut-1-en-2-yl)piperidine
CID 131971570
1-[(2E,4Z)-5-methylhepta-2,4,6-trien-2-yl]piperidin-4-ol
CID 142260643
Ethane;1-[methyl(prop-1-en-2-yl)amino]pentan-3-ol
CID 143547341
1-(1-Cyclopropylethenyl)piperidin-4-ol
CID 145089576
1-Pent-1-en-2-ylpiperidin-3-ol
CID 146430036
1-But-1-en-2-ylpiperidin-3-ol
CID 147998729
2,2-Dimethyl-1-prop-1-en-2-ylpiperidin-4-ol
CID 153592542
4-Methyl-1-pent-1-en-2-ylpiperidin-3-ol
CID 155200004
1-(4,4-Dimethylhex-1-en-2-yl)piperidin-4-ol
CID 155789893

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylbut-1-en-2-yl)piperidin-4-ol?
The IUPAC name of 1-(3-methylbut-1-en-2-yl)piperidin-4-ol (CID 142588017) is 1-(3-methylbut-1-en-2-yl)piperidin-4-ol.
What is the SMILES notation for 1-(3-methylbut-1-en-2-yl)piperidin-4-ol?
The canonical SMILES for 1-(3-methylbut-1-en-2-yl)piperidin-4-ol is C=C(C(C)C)N1CCC(O)CC1.
What is the InChIKey of 1-(3-methylbut-1-en-2-yl)piperidin-4-ol?
The InChIKey is BXIUWWWRGZWHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-8(2)9(3)11-6-4-10(12)5-7-11/h8,10,12H,3-7H2,1-2H3.
What are the key properties of 1-(3-methylbut-1-en-2-yl)piperidin-4-ol?
1-(3-methylbut-1-en-2-yl)piperidin-4-ol has a molecular weight of 169.27 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylbut-1-en-2-yl)piperidin-4-ol is sourced from PubChem (CID 142588017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).