(1,4-dimethylpiperidin-2-yl)-phenylmethanol

C14H21NO — CID 68502883

IUPAC(1,4-dimethylpiperidin-2-yl)-phenylmethanol
SMILESCC1CCN(C)C(C(O)c2ccccc2)C1
InChIInChI=1S/C14H21NO/c1-11-8-9-15(2)13(10-11)14(16)12-6-4-3-5-7-12/h3-7,11,13-14,16H,8-10H2,1-2H3
InChIKeyXYZNNGHJPKPIPB-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.45
Rot. Bonds2

About (1,4-dimethylpiperidin-2-yl)-phenylmethanol

(1,4-dimethylpiperidin-2-yl)-phenylmethanol (PubChem CID 68502883) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (1,4-dimethylpiperidin-2-yl)-phenylmethanol.

Molecular Properties

Compound Name(1,4-dimethylpiperidin-2-yl)-phenylmethanol
PubChem CID68502883
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(1,4-dimethylpiperidin-2-yl)-phenylmethanol
SMILESCC1CCN(C)C(C(O)c2ccccc2)C1
InChIInChI=1S/C14H21NO/c1-11-8-9-15(2)13(10-11)14(16)12-6-4-3-5-7-12/h3-7,11,13-14,16H,8-10H2,1-2H3
InChIKeyXYZNNGHJPKPIPB-UHFFFAOYSA-N
XLogP2.45
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2S)-1-methylpiperidin-2-yl]-phenylmethanol
CID 67164631
(3,5-dimethylcyclohexyl)-phenylmethanol
CID 64730076
2-benzhydryl-1-methylpyrrolidine
CID 71178925
phenyl-(1-phenylpyrrolidin-2-yl)methanol
CID 164523197
(R)-[(2R,3aR,6aR)-1-[2-[(2R,3aR,6aR)-2-[(R)-hydroxy(phenyl)methyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-yl]ethyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-2-yl]-phenylmethanol
CID 100992937
(1-benzylpiperidin-2-yl)-phenylmethanol
CID 14816704
(R)-phenyl-[(2R)-1-[(1R)-1-phenylethyl]aziridin-2-yl]methanol
CID 134930781
(3,4-dimethylcyclohexyl)-phenylmethanol
CID 64740008
[(2S,4R)-4-methylpyrrolidin-2-yl]-phenylmethanol
CID 101194740
(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol
CID 103788675
(R)-(2-methylidenecyclohexyl)-phenylmethanol
CID 101364678
2-hydroxy-1-(3-methylcyclohexyl)-2-phenylethanone
CID 103458039

Frequently Asked Questions

What is the IUPAC name of (1,4-dimethylpiperidin-2-yl)-phenylmethanol?
The IUPAC name of (1,4-dimethylpiperidin-2-yl)-phenylmethanol (CID 68502883) is (1,4-dimethylpiperidin-2-yl)-phenylmethanol.
What is the SMILES notation for (1,4-dimethylpiperidin-2-yl)-phenylmethanol?
The canonical SMILES for (1,4-dimethylpiperidin-2-yl)-phenylmethanol is CC1CCN(C)C(C(O)c2ccccc2)C1.
What is the InChIKey of (1,4-dimethylpiperidin-2-yl)-phenylmethanol?
The InChIKey is XYZNNGHJPKPIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-8-9-15(2)13(10-11)14(16)12-6-4-3-5-7-12/h3-7,11,13-14,16H,8-10H2,1-2H3.
What are the key properties of (1,4-dimethylpiperidin-2-yl)-phenylmethanol?
(1,4-dimethylpiperidin-2-yl)-phenylmethanol has a molecular weight of 219.33 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,4-dimethylpiperidin-2-yl)-phenylmethanol is sourced from PubChem (CID 68502883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).