N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide

C17H24N2O2 — CID 50963327

IUPACN-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide
SMILESCCN(C/C=C/c1ccccc1)C(=O)CCN1CCCO1
InChIInChI=1S/C17H24N2O2/c1-2-18(12-6-10-16-8-4-3-5-9-16)17(20)11-14-19-13-7-15-21-19/h3-6,8-10H,2,7,11-15H2,1H3/b10-6+
InChIKeyIYQNVCAPCZQKNV-UXBLZVDNSA-N
MW288.39 g/mol
LogP2.58
Rot. Bonds7

About N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide

N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide (PubChem CID 50963327) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide.

Molecular Properties

Compound NameN-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide
PubChem CID50963327
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide
SMILESCCN(C/C=C/c1ccccc1)C(=O)CCN1CCCO1
InChIInChI=1S/C17H24N2O2/c1-2-18(12-6-10-16-8-4-3-5-9-16)17(20)11-14-19-13-7-15-21-19/h3-6,8-10H,2,7,11-15H2,1H3/b10-6+
InChIKeyIYQNVCAPCZQKNV-UXBLZVDNSA-N
XLogP2.58
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(E)-3-phenylprop-2-enyl]-N-(2-pyrrolidin-1-ylethyl)nonanamide
CID 42697019
3-(2,4-dioxopyrimidin-1-yl)-N-ethyl-N-[(E)-3-phenylprop-2-enyl]propanamide
CID 50982925
2-[3-(dimethylamino)pyrrolidin-1-yl]-N-ethyl-N-[(E)-3-phenylprop-2-enyl]acetamide
CID 91841784
N-ethyl-2-(2-methoxyphenyl)-N-[(E)-3-phenylprop-2-enyl]acetamide
CID 46995618
N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide
CID 76600124
ethyl 1-[3-(oxazinan-2-yl)propanoyl]-3-[(E)-3-phenylprop-2-enyl]piperidine-3-carboxylate
CID 45232755
N-ethyl-N-[(E)-3-phenylprop-2-enyl]oxolane-3-carboxamide
CID 50962275
N-ethyl-3-(1-methyltetrazol-5-yl)sulfanyl-N-[(E)-3-phenylprop-2-enyl]propanamide
CID 46983852
N,N-diethyl-4-phenylbut-3-enamide
CID 71333088
N-ethyl-5-[(4-methylpiperazin-1-yl)methyl]-N-[(E)-3-phenylprop-2-enyl]furan-2-carboxamide
CID 50983656
N-ethyl-2-methyl-N-[(Z)-3-phenylprop-2-enyl]butanamide
CID 122692160
3-butyl-1-[(E)-3-phenylprop-2-enyl]-1-(2-piperidin-1-ylethyl)urea
CID 42702437

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
The IUPAC name of N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide (CID 50963327) is N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide.
What is the SMILES notation for N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
The canonical SMILES for N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide is CCN(C/C=C/c1ccccc1)C(=O)CCN1CCCO1.
What is the InChIKey of N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
The InChIKey is IYQNVCAPCZQKNV-UXBLZVDNSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-18(12-6-10-16-8-4-3-5-9-16)17(20)11-14-19-13-7-15-21-19/h3-6,8-10H,2,7,11-15H2,1H3/b10-6+.
What are the key properties of N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide has a molecular weight of 288.39 g/mol, XLogP of 2.58, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(1,2-oxazolidin-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide is sourced from PubChem (CID 50963327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).