1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol

C15H21NO — CID 127265628

IUPAC1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol
SMILESCC(=Cc1ccccc1)CN1CCCC(O)C1
InChIInChI=1S/C15H21NO/c1-13(10-14-6-3-2-4-7-14)11-16-9-5-8-15(17)12-16/h2-4,6-7,10,15,17H,5,8-9,11-12H2,1H3
InChIKeyGHLAWSWLBBYGOW-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.55
Rot. Bonds3

About 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol

1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol (PubChem CID 127265628) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol
PubChem CID127265628
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol
SMILESCC(=Cc1ccccc1)CN1CCCC(O)C1
InChIInChI=1S/C15H21NO/c1-13(10-14-6-3-2-4-7-14)11-16-9-5-8-15(17)12-16/h2-4,6-7,10,15,17H,5,8-9,11-12H2,1H3
InChIKeyGHLAWSWLBBYGOW-UHFFFAOYSA-N
XLogP2.55
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-3-ol
CID 30981090
(3R)-1-[(Z)-2-methyl-3-phenylprop-2-enyl]pyrrolidin-3-ol
CID 86781785
(3R)-N,N-diethyl-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidine-3-carboxamide
CID 782727
N-[2-[1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-3-yl]ethyl]methanesulfonamide
CID 56741459
(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol
CID 30981598
1-(3-chloro-2-methylprop-2-enyl)piperidin-3-ol
CID 106439835
[(1R,5S)-3-(2-methyl-3-phenylprop-2-enyl)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 154779546
3-[1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-3-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
CID 110260260
2-[1-[(E)-2-methyl-3-phenylprop-2-enyl]azetidin-3-yl]ethanol
CID 138045097
1-[2-(2,5-dimethylpyrrolidin-1-yl)ethyl]-4-[(E)-2-methyl-3-phenylprop-2-enyl]piperazine
CID 138042151
4-methoxy-N-[[1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-3-yl]methyl]benzenesulfonamide
CID 45226658
9-(cyclopropylmethyl)-2-[(E)-2-methyl-3-phenylprop-2-enyl]-2,9-diazaspiro[4.5]decane
CID 45174619

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol?
The IUPAC name of 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol (CID 127265628) is 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol.
What is the SMILES notation for 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol?
The canonical SMILES for 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol is CC(=Cc1ccccc1)CN1CCCC(O)C1.
What is the InChIKey of 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol?
The InChIKey is GHLAWSWLBBYGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-13(10-14-6-3-2-4-7-14)11-16-9-5-8-15(17)12-16/h2-4,6-7,10,15,17H,5,8-9,11-12H2,1H3.
What are the key properties of 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol?
1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol has a molecular weight of 231.34 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol is sourced from PubChem (CID 127265628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).