2-methyl-2-piperidin-1-ylhexan-3-ol

C12H25NO — CID 79045077

IUPAC2-methyl-2-piperidin-1-ylhexan-3-ol
SMILESCCCC(O)C(C)(C)N1CCCCC1
InChIInChI=1S/C12H25NO/c1-4-8-11(14)12(2,3)13-9-6-5-7-10-13/h11,14H,4-10H2,1-3H3
InChIKeyVJOBKWOVFWWVMX-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.41
Rot. Bonds4

About 2-methyl-2-piperidin-1-ylhexan-3-ol

2-methyl-2-piperidin-1-ylhexan-3-ol (PubChem CID 79045077) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-methyl-2-piperidin-1-ylhexan-3-ol.

Molecular Properties

Compound Name2-methyl-2-piperidin-1-ylhexan-3-ol
PubChem CID79045077
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-methyl-2-piperidin-1-ylhexan-3-ol
SMILESCCCC(O)C(C)(C)N1CCCCC1
InChIInChI=1S/C12H25NO/c1-4-8-11(14)12(2,3)13-9-6-5-7-10-13/h11,14H,4-10H2,1-3H3
InChIKeyVJOBKWOVFWWVMX-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,7,7-trimethyl-2-pyrrolidin-1-yloctan-3-ol
CID 114209872
2-methyl-2-piperidin-1-yloct-6-yn-3-ol
CID 104803983
2,4-dimethyl-2-pyrrolidin-1-ylheptan-3-ol
CID 107892960
2,5-dimethyl-2-pyrrolidin-1-ylhexan-3-ol
CID 79056027
1-cyclopropyl-3-methyl-3-piperidin-1-ylbutan-2-ol
CID 79044925
2-methyl-2-piperidin-1-yldec-9-en-3-ol
CID 107008615
2-methyl-6-methylsulfonyl-2-pyrrolidin-1-ylhexan-3-ol
CID 79056525
2-methyl-2-piperidin-1-ylhept-5-yn-3-ol
CID 79045084
4-(azepan-1-yl)-4-methyl-1-(oxolan-2-yl)pentan-3-ol
CID 79051804
4-methyl-1-phenyl-4-pyrrolidin-1-ylpentan-3-ol
CID 79056520
N,2,5-trimethyl-2-piperidin-1-yloctan-3-amine
CID 79045179
N,2-dimethyl-2-piperidin-1-ylheptan-3-amine
CID 79045929

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-piperidin-1-ylhexan-3-ol?
The IUPAC name of 2-methyl-2-piperidin-1-ylhexan-3-ol (CID 79045077) is 2-methyl-2-piperidin-1-ylhexan-3-ol.
What is the SMILES notation for 2-methyl-2-piperidin-1-ylhexan-3-ol?
The canonical SMILES for 2-methyl-2-piperidin-1-ylhexan-3-ol is CCCC(O)C(C)(C)N1CCCCC1.
What is the InChIKey of 2-methyl-2-piperidin-1-ylhexan-3-ol?
The InChIKey is VJOBKWOVFWWVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-8-11(14)12(2,3)13-9-6-5-7-10-13/h11,14H,4-10H2,1-3H3.
What are the key properties of 2-methyl-2-piperidin-1-ylhexan-3-ol?
2-methyl-2-piperidin-1-ylhexan-3-ol has a molecular weight of 199.34 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-piperidin-1-ylhexan-3-ol is sourced from PubChem (CID 79045077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).