(E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine

C25H27N — CID 59845319

IUPAC(E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine
SMILESC/C(=C\N(Cc1ccc(C)cc1)Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C25H27N/c1-20-9-13-23(14-10-20)18-26(19-24-15-11-21(2)12-16-24)17-22(3)25-7-5-4-6-8-25/h4-17H,18-19H2,1-3H3/b22-17+
InChIKeyRKUSVRSMBCEMST-OQKWZONESA-N
MW341.50 g/mol
LogP6.37
Rot. Bonds6

About (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine

(E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine (PubChem CID 59845319) has the molecular formula C25H27N and a molecular weight of 341.50 g/mol. Its IUPAC name is (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine.

Molecular Properties

Compound Name(E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine
PubChem CID59845319
Molecular FormulaC25H27N
Molecular Weight341.50 g/mol
Exact Mass341.21
IUPAC Name(E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine
SMILESC/C(=C\N(Cc1ccc(C)cc1)Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C25H27N/c1-20-9-13-23(14-10-20)18-26(19-24-15-11-21(2)12-16-24)17-22(3)25-7-5-4-6-8-25/h4-17H,18-19H2,1-3H3/b22-17+
InChIKeyRKUSVRSMBCEMST-OQKWZONESA-N
XLogP6.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.50
LogP ≤ 56.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 143180234
1-methyl-4-(4-phenylpent-3-en-2-yl)benzene
CID 173216306
N-[(4-methylphenyl)methyl]-N-phenylacetamide
CID 10995887
(E)-2-phenyl-N,N-bis(trimethylsilyl)prop-1-en-1-amine
CID 12930792
[(E)-1-chloroprop-1-en-2-yl]benzene
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(E)-N,N-dibenzyl-1,2-bis(4-methylphenyl)ethenamine
CID 132850322
1-methyl-4-(4-phenylpenta-1,3-dienyl)benzene
CID 54269613
N-[2,2-bis(4-methylphenyl)ethenyl]-4-ethyl-N-(4-ethylphenyl)aniline;N-[2,2-bis(4-methylphenyl)ethenyl]-N-phenylaniline;N-(2,2-diphenylethenyl)-N-(4-ethylphenyl)-4-methylaniline
CID 158670691
1-methyl-4-[(2E,5E)-6-(4-methylphenyl)hepta-2,5-dien-2-yl]benzene
CID 169013280
N-benzyl-N-[(E)-3-(4-methylphenyl)prop-2-enyl]ethanethioamide
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1-but-2-en-2-yl-4-methylbenzene
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CID 58843251

Frequently Asked Questions

What is the IUPAC name of (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine?
The IUPAC name of (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine (CID 59845319) is (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine.
What is the SMILES notation for (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine?
The canonical SMILES for (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine is C/C(=C\N(Cc1ccc(C)cc1)Cc1ccc(C)cc1)c1ccccc1.
What is the InChIKey of (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine?
The InChIKey is RKUSVRSMBCEMST-OQKWZONESA-N. The full InChI is InChI=1S/C25H27N/c1-20-9-13-23(14-10-20)18-26(19-24-15-11-21(2)12-16-24)17-22(3)25-7-5-4-6-8-25/h4-17H,18-19H2,1-3H3/b22-17+.
What are the key properties of (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine?
(E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine has a molecular weight of 341.50 g/mol, XLogP of 6.37, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-bis[(4-methylphenyl)methyl]-2-phenylprop-1-en-1-amine is sourced from PubChem (CID 59845319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).