1-Benzyl-2-methylpiperidin-3-ol

C13H19NO — CID 83848242

IUPAC1-benzyl-2-methylpiperidin-3-ol
SMILESCC1C(CCCN1CC2=CC=CC=C2)O
InChIInChI=1S/C13H19NO/c1-11-13(15)8-5-9-14(11)10-12-6-3-2-4-7-12/h2-4,6-7,11,13,15H,5,8-10H2,1H3
InChIKeyZFJGRVQFTNBLRP-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.10
Rot. Bonds2

About 1-Benzyl-2-methylpiperidin-3-ol

1-Benzyl-2-methylpiperidin-3-ol (PubChem CID 83848242) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-benzyl-2-methylpiperidin-3-ol.

Molecular Properties

Compound Name1-Benzyl-2-methylpiperidin-3-ol
PubChem CID83848242
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-benzyl-2-methylpiperidin-3-ol
SMILESCC1C(CCCN1CC2=CC=CC=C2)O
InChIInChI=1S/C13H19NO/c1-11-13(15)8-5-9-14(11)10-12-6-3-2-4-7-12/h2-4,6-7,11,13,15H,5,8-10H2,1H3
InChIKeyZFJGRVQFTNBLRP-UHFFFAOYSA-N
XLogP2.10
TPSA23.50 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity189

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-Phenylcyclohexyl)-4-hydroxypiperidine
CID 98840
2,2'-((Phenylmethyl)imino)bisethanol
CID 7553
N,N-Dibenzylethanolamine
CID 22657
1-(2-Phenylethyl)-4-piperidinol
CID 77055
1-(Diphenylmethyl)azetidin-3-ol
CID 330448
1-Benzylpiperidin-3-ol
CID 85773
N-Benzyl-N-methylethanolamine
CID 66876
[(2R)-1,4-dibenzylpiperazin-2-yl]methanol
CID 9994741
2-[2-Hydroxyethyl-[(4-methylphenyl)methyl]amino]ethanol
CID 4219208
1-(4-Fluorobenzyl)-4-(2-Hydroxyethyl)Piperazine
CID 693807
1-Benzylpiperidin-4-ol
CID 78461
2-(Benzylamino)propan-1-ol
CID 138873

Frequently Asked Questions

What is the IUPAC name of 1-Benzyl-2-methylpiperidin-3-ol?
The IUPAC name of 1-Benzyl-2-methylpiperidin-3-ol (CID 83848242) is 1-benzyl-2-methylpiperidin-3-ol.
What is the SMILES notation for 1-Benzyl-2-methylpiperidin-3-ol?
The canonical SMILES for 1-Benzyl-2-methylpiperidin-3-ol is CC1C(CCCN1CC2=CC=CC=C2)O.
What is the InChIKey of 1-Benzyl-2-methylpiperidin-3-ol?
The InChIKey is ZFJGRVQFTNBLRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-11-13(15)8-5-9-14(11)10-12-6-3-2-4-7-12/h2-4,6-7,11,13,15H,5,8-10H2,1H3.
What are the key properties of 1-Benzyl-2-methylpiperidin-3-ol?
1-Benzyl-2-methylpiperidin-3-ol has a molecular weight of 205.30 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Benzyl-2-methylpiperidin-3-ol is sourced from PubChem (CID 83848242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).