4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol

C15H27NO — CID 106650855

IUPAC4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol
SMILESCC(C)N1CCC(O)(C2=CCCCCC2)CC1
InChIInChI=1S/C15H27NO/c1-13(2)16-11-9-15(17,10-12-16)14-7-5-3-4-6-8-14/h7,13,17H,3-6,8-12H2,1-2H3
InChIKeyTWKCLCAXPSALJM-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.11
Rot. Bonds2

About 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol

4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol (PubChem CID 106650855) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol
PubChem CID106650855
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol
SMILESCC(C)N1CCC(O)(C2=CCCCCC2)CC1
InChIInChI=1S/C15H27NO/c1-13(2)16-11-9-15(17,10-12-16)14-7-5-3-4-6-8-14/h7,13,17H,3-6,8-12H2,1-2H3
InChIKeyTWKCLCAXPSALJM-UHFFFAOYSA-N
XLogP3.11
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,1-Di(cyclohexen-1-yl)-2-(dimethylamino)propan-1-ol
CID 19608986
4-[(E)-but-1-enyl]-1,2,2,6,6-pentamethylpiperidin-4-ol
CID 20501086
4-But-1-enyl-1,2,2,6,6-pentamethylpiperidin-4-ol
CID 54144531
1,2,2,6,6-Pentamethyl-4-prop-1-enylpiperidin-4-ol
CID 54237835
(Dimethylaminoethyl)bis(1-cyclohexenyl)-methanol
CID 54563448
2-(1-Hydroxy-1-propyl)-(6-methyl-6-azabicyclo[3.2.2]non-2-ene)
CID 67020382
1,2,2,6,6-pentamethyl-4-[(Z)-prop-1-enyl]piperidin-4-ol
CID 70524040
3-(2-Methylprop-1-enyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 79190226
1,2-Dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol
CID 81611309
7-(2-methylprop-1-enyl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-ol
CID 81611936
1-(2-methylprop-1-enyl)-3,5,6,7,8,8a-hexahydro-2H-indolizin-1-ol
CID 81886676
2-[(1R,6R)-9-methyl-9-azabicyclo[4.2.1]non-2-en-2-yl]propan-2-ol
CID 101613769

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol?
The IUPAC name of 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol (CID 106650855) is 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol.
What is the SMILES notation for 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol?
The canonical SMILES for 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol is CC(C)N1CCC(O)(C2=CCCCCC2)CC1.
What is the InChIKey of 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol?
The InChIKey is TWKCLCAXPSALJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-13(2)16-11-9-15(17,10-12-16)14-7-5-3-4-6-8-14/h7,13,17H,3-6,8-12H2,1-2H3.
What are the key properties of 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol?
4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol has a molecular weight of 237.39 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohepten-1-yl)-1-propan-2-ylpiperidin-4-ol is sourced from PubChem (CID 106650855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).