4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol

C18H34N2O — CID 62609383

IUPAC4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol
SMILESCC1CCC(O)C(CN2CCC(N3CCCCC3)CC2)C1
InChIInChI=1S/C18H34N2O/c1-15-5-6-18(21)16(13-15)14-19-11-7-17(8-12-19)20-9-3-2-4-10-20/h15-18,21H,2-14H2,1H3
InChIKeyXWLBATWVNWVEJW-UHFFFAOYSA-N
MW294.48 g/mol
LogP2.73
Rot. Bonds3

About 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol

4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol (PubChem CID 62609383) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol
PubChem CID62609383
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol
SMILESCC1CCC(O)C(CN2CCC(N3CCCCC3)CC2)C1
InChIInChI=1S/C18H34N2O/c1-15-5-6-18(21)16(13-15)14-19-11-7-17(8-12-19)20-9-3-2-4-10-20/h15-18,21H,2-14H2,1H3
InChIKeyXWLBATWVNWVEJW-UHFFFAOYSA-N
XLogP2.73
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)-4-methylcyclohexan-1-ol
CID 79925117
2-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
CID 63169189
1-[(2-methylpyrrolidin-3-yl)methyl]-4-piperidin-1-ylpiperidine
CID 79384542
4-methyl-2-[(2-methylpyrrolidin-1-yl)methyl]cyclohexan-1-ol
CID 62610048
4-propyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-ol
CID 62611262
2-[(4-methylpiperidin-1-yl)methyl]cyclopentan-1-ol
CID 62611098
4-methyl-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]cyclohexan-1-ol
CID 62610121
4-methyl-2-[(3-propoxypiperidin-1-yl)methyl]cyclohexan-1-ol
CID 55094581
2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol
CID 107395253
methyl acetate;4-methyl-1-[[(1S,2S)-2-methyl-4-piperidin-1-ylcyclopentyl]methyl]piperidine
CID 90921020
N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine
CID 66258170
2-(pyrrolidin-1-ylmethyl)cycloheptan-1-ol
CID 51345852

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol (CID 62609383) is 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol is CC1CCC(O)C(CN2CCC(N3CCCCC3)CC2)C1.
What is the InChIKey of 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol?
The InChIKey is XWLBATWVNWVEJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-15-5-6-18(21)16(13-15)14-19-11-7-17(8-12-19)20-9-3-2-4-10-20/h15-18,21H,2-14H2,1H3.
What are the key properties of 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol?
4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol has a molecular weight of 294.48 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 62609383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).