(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine

C17H19N — CID 7202013

IUPAC(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine
SMILESC[C@@H](NC/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-15(17-12-6-3-7-13-17)18-14-8-11-16-9-4-2-5-10-16/h2-13,15,18H,14H2,1H3/b11-8+/t15-/m1/s1
InChIKeyNDGYDBMQLKJWKE-KUCQQTCKSA-N
MW237.35 g/mol
LogP4.05
Rot. Bonds5

About (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine

(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine (PubChem CID 7202013) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine.

Molecular Properties

Compound Name(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine
PubChem CID7202013
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine
SMILESC[C@@H](NC/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-15(17-12-6-3-7-13-17)18-14-8-11-16-9-4-2-5-10-16/h2-13,15,18H,14H2,1H3/b11-8+/t15-/m1/s1
InChIKeyNDGYDBMQLKJWKE-KUCQQTCKSA-N
XLogP4.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-3-phenyl-N-[(1S)-1-phenylethyl]prop-2-en-1-amine
CID 15311491
(E)-N-[(1R)-1-phenylethyl]-3-(4-phenylphenyl)prop-2-en-1-amine
CID 73336131
N-[(1R)-1-phenylethyl]-3-(4-phenylphenyl)prop-2-en-1-amine
CID 123802706
3-phenyl-N-propan-2-ylprop-2-en-1-amine
CID 54218883
N-[4-[1-[[(E)-3-phenylprop-2-enyl]amino]ethyl]phenyl]methanesulfonamide
CID 56823426
(Z)-4-methyl-N-[(1S)-1-phenylethyl]pent-2-en-1-amine
CID 102078322
(E)-3-phenyl-N-[(1R)-1-thiophen-2-ylethyl]prop-2-en-1-amine
CID 81408581
(2S)-1-phenyl-N-[(Z)-3-phenylprop-2-enyl]propan-2-amine
CID 124647336
2-[[(1S)-1-phenylethyl]amino]acetaldehyde
CID 173253392
3-methyl-2-(3-phenylprop-2-enylamino)butanoic acid
CID 71827506
2-(3-phenylprop-2-enylamino)propane-1,3-diol
CID 77065033
(E)-N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-phenylprop-2-en-1-amine
CID 112696883

Frequently Asked Questions

What is the IUPAC name of (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine?
The IUPAC name of (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine (CID 7202013) is (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine.
What is the SMILES notation for (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine?
The canonical SMILES for (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine is C[C@@H](NC/C=C/c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine?
The InChIKey is NDGYDBMQLKJWKE-KUCQQTCKSA-N. The full InChI is InChI=1S/C17H19N/c1-15(17-12-6-3-7-13-17)18-14-8-11-16-9-4-2-5-10-16/h2-13,15,18H,14H2,1H3/b11-8+/t15-/m1/s1.
What are the key properties of (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine?
(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine has a molecular weight of 237.35 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine is sourced from PubChem (CID 7202013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).