(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine

C20H24N2 — CID 42463367

IUPAC(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine
SMILESC(=C/c1ccccc1)\CN1CCC[C@@H](Nc2ccccc2)C1
InChIInChI=1S/C20H24N2/c1-3-9-18(10-4-1)11-7-15-22-16-8-14-20(17-22)21-19-12-5-2-6-13-19/h1-7,9-13,20-21H,8,14-17H2/b11-7+/t20-/m1/s1
InChIKeyABRZVFVJDZJSCD-WUTDNEBXSA-N
MW292.43 g/mol
LogP4.28
Rot. Bonds5

About (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine

(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine (PubChem CID 42463367) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine
PubChem CID42463367
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine
SMILESC(=C/c1ccccc1)\CN1CCC[C@@H](Nc2ccccc2)C1
InChIInChI=1S/C20H24N2/c1-3-9-18(10-4-1)11-7-15-22-16-8-14-20(17-22)21-19-12-5-2-6-13-19/h1-7,9-13,20-21H,8,14-17H2/b11-7+/t20-/m1/s1
InChIKeyABRZVFVJDZJSCD-WUTDNEBXSA-N
XLogP4.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]acetamide
CID 172882645
1-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]ethanamine
CID 63845047
(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-ol
CID 30981598
4-N,4-N-dimethyl-2-N-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]pyrimidine-2,4-diamine
CID 171998580
[(3R)-1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]methanol
CID 129367097
N-methyl-1-[(E)-4-phenylbut-3-enyl]piperidin-3-amine
CID 66569635
1-[(E)-3-phenylprop-2-enyl]azepane
CID 10867670
2-[1-(3-phenylprop-2-enyl)piperidin-3-yl]acetic acid
CID 76954218
N-[[(3R)-1-methylpiperidin-3-yl]methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide
CID 126442087
N-cyclopentyl-3-oxo-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide
CID 108942180
4-[1-[(E)-3-phenylprop-2-enyl]piperidin-3-yl]pyrimidine
CID 74242201
(3R)-1-[(E)-3-phenylprop-2-enyl]pyrrolidin-3-ol
CID 129368573

Frequently Asked Questions

What is the IUPAC name of (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine?
The IUPAC name of (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine (CID 42463367) is (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine.
What is the SMILES notation for (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine?
The canonical SMILES for (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine is C(=C/c1ccccc1)\CN1CCC[C@@H](Nc2ccccc2)C1.
What is the InChIKey of (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine?
The InChIKey is ABRZVFVJDZJSCD-WUTDNEBXSA-N. The full InChI is InChI=1S/C20H24N2/c1-3-9-18(10-4-1)11-7-15-22-16-8-14-20(17-22)21-19-12-5-2-6-13-19/h1-7,9-13,20-21H,8,14-17H2/b11-7+/t20-/m1/s1.
What are the key properties of (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine?
(3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine has a molecular weight of 292.43 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-phenyl-1-[(E)-3-phenylprop-2-enyl]piperidin-3-amine is sourced from PubChem (CID 42463367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).