(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide

C24H25NO2 — CID 19174605

IUPAC(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
SMILESCC(C)c1ccc(/C=C/C(=O)NCCOc2cccc3ccccc23)cc1
InChIInChI=1S/C24H25NO2/c1-18(2)20-13-10-19(11-14-20)12-15-24(26)25-16-17-27-23-9-5-7-21-6-3-4-8-22(21)23/h3-15,18H,16-17H2,1-2H3,(H,25,26)/b15-12+
InChIKeyXPQGNPQYJOYMRS-NTCAYCPXSA-N
MW359.47 g/mol
LogP5.17
Rot. Bonds7

About (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide

(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide (PubChem CID 19174605) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
PubChem CID19174605
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC Name(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
SMILESCC(C)c1ccc(/C=C/C(=O)NCCOc2cccc3ccccc23)cc1
InChIInChI=1S/C24H25NO2/c1-18(2)20-13-10-19(11-14-20)12-15-24(26)25-16-17-27-23-9-5-7-21-6-3-4-8-22(21)23/h3-15,18H,16-17H2,1-2H3,(H,25,26)/b15-12+
InChIKeyXPQGNPQYJOYMRS-NTCAYCPXSA-N
XLogP5.17
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-nitrophenyl)prop-2-enamide
CID 94848384
N-(2-methoxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 2927461
(E)-3-(4-ethoxy-3-methoxyphenyl)-N-(2-naphthalen-1-yloxyethyl)prop-2-enamide
CID 19174613
(Z)-3-(4-propan-2-ylphenyl)-N-[4-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]butyl]prop-2-enamide
CID 92971155
(E)-3-(4-propan-2-ylphenyl)-N-propylprop-2-enamide
CID 6159715
3-(3,4-dimethoxyphenyl)-N-[2-(2-methoxyphenoxy)ethyl]prop-2-enamide
CID 5217365
(E)-N-but-3-enyl-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 113466047
methyl 4-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]butanoate
CID 102534511
2-(2-chlorophenoxy)-N-(2-naphthalen-1-yloxyethyl)propanamide
CID 133220502
N-octyl-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 4115175
N-[(4-methoxyphenyl)methyl]-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 897847
(2S)-2-amino-4-methyl-N-(2-naphthalen-1-yloxyethyl)pentanamide
CID 119738781

Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide?
The IUPAC name of (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide (CID 19174605) is (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide.
What is the SMILES notation for (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide?
The canonical SMILES for (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide is CC(C)c1ccc(/C=C/C(=O)NCCOc2cccc3ccccc23)cc1.
What is the InChIKey of (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide?
The InChIKey is XPQGNPQYJOYMRS-NTCAYCPXSA-N. The full InChI is InChI=1S/C24H25NO2/c1-18(2)20-13-10-19(11-14-20)12-15-24(26)25-16-17-27-23-9-5-7-21-6-3-4-8-22(21)23/h3-15,18H,16-17H2,1-2H3,(H,25,26)/b15-12+.
What are the key properties of (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide?
(E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide has a molecular weight of 359.47 g/mol, XLogP of 5.17, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-naphthalen-1-yloxyethyl)-3-(4-propan-2-ylphenyl)prop-2-enamide is sourced from PubChem (CID 19174605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).