1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol

C12H23NO — CID 11820042

IUPAC1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol
SMILESCN1CCCC[C@H]1C1(O)CCCCC1
InChIInChI=1S/C12H23NO/c1-13-10-6-3-7-11(13)12(14)8-4-2-5-9-12/h11,14H,2-10H2,1H3/t11-/m0/s1
InChIKeyHFGHNIKJNWIJGS-NSHDSACASA-N
MW197.32 g/mol
LogP2.17
Rot. Bonds1

About 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol

1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol (PubChem CID 11820042) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol
PubChem CID11820042
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol
SMILESCN1CCCC[C@H]1C1(O)CCCCC1
InChIInChI=1S/C12H23NO/c1-13-10-6-3-7-11(13)12(14)8-4-2-5-9-12/h11,14H,2-10H2,1H3/t11-/m0/s1
InChIKeyHFGHNIKJNWIJGS-NSHDSACASA-N
XLogP2.17
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol?
The IUPAC name of 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol (CID 11820042) is 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol is CN1CCCC[C@H]1C1(O)CCCCC1.
What is the InChIKey of 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol?
The InChIKey is HFGHNIKJNWIJGS-NSHDSACASA-N. The full InChI is InChI=1S/C12H23NO/c1-13-10-6-3-7-11(13)12(14)8-4-2-5-9-12/h11,14H,2-10H2,1H3/t11-/m0/s1.
What are the key properties of 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol?
1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 11820042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).