[1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine

C15H22N2 — CID 76923183

IUPAC[1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine
SMILESNCC1CCN(CC=Cc2ccccc2)CC1
InChIInChI=1S/C15H22N2/c16-13-15-8-11-17(12-9-15)10-4-7-14-5-2-1-3-6-14/h1-7,15H,8-13,16H2
InChIKeyYTPVVJXNAPIVTL-UHFFFAOYSA-N
MW230.36 g/mol
LogP2.37
Rot. Bonds4

About [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine

[1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine (PubChem CID 76923183) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine
PubChem CID76923183
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC Name[1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine
SMILESNCC1CCN(CC=Cc2ccccc2)CC1
InChIInChI=1S/C15H22N2/c16-13-15-8-11-17(12-9-15)10-4-7-14-5-2-1-3-6-14/h1-7,15H,8-13,16H2
InChIKeyYTPVVJXNAPIVTL-UHFFFAOYSA-N
XLogP2.37
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-(3-phenylprop-2-enyl)piperidin-4-yl]propanoic acid
CID 76937513
1-[(E)-3-phenylprop-2-enyl]azepane
CID 10867670
(3R)-1-[(E)-3-phenylprop-2-enyl]pyrrolidin-3-ol
CID 129368573
1-(1-ethylpiperidin-4-yl)-4-(3-phenylprop-2-enyl)piperazine
CID 2846660
1-(3-phenylprop-2-enyl)pyrrolidine-3-carboxylic acid
CID 76985412
[1-[(E)-4-phenylbut-3-enyl]piperidin-3-yl]methanamine
CID 66570063
1-(2-chloroethyl)-4-(3-phenylprop-2-enyl)piperazine
CID 54353609
1-[(Z)-3-phenylprop-2-enyl]-4-(1-propylpiperidin-4-yl)piperazine
CID 92898605
[(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]methanol
CID 129367097
[(3R,4R)-4-phenyl-1-[(E)-3-phenylprop-2-enyl]pyrrolidin-3-yl]methanamine
CID 120769292
1-[(E)-3-phenylprop-2-enyl]-4-[(2-propan-2-ylimidazol-1-yl)methyl]piperidine
CID 90494159
2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]acetic acid
CID 43397283

Frequently Asked Questions

What is the IUPAC name of [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine (CID 76923183) is [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine is NCC1CCN(CC=Cc2ccccc2)CC1.
What is the InChIKey of [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine?
The InChIKey is YTPVVJXNAPIVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c16-13-15-8-11-17(12-9-15)10-4-7-14-5-2-1-3-6-14/h1-7,15H,8-13,16H2.
What are the key properties of [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine?
[1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine has a molecular weight of 230.36 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-phenylprop-2-enyl)piperidin-4-yl]methanamine is sourced from PubChem (CID 76923183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).