N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide

C25H24N2O2 — CID 18706907

IUPACN-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide
SMILESCCc1c(-c2ccc(OCc3ccccc3)cc2)cn2cc(NC(C)=O)ccc12
InChIInChI=1S/C25H24N2O2/c1-3-23-24(16-27-15-21(26-18(2)28)11-14-25(23)27)20-9-12-22(13-10-20)29-17-19-7-5-4-6-8-19/h4-16H,3,17H2,1-2H3,(H,26,28)
InChIKeyCNVOZMHPMFCXKG-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.71
Rot. Bonds6

About N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide

N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide (PubChem CID 18706907) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide.

Molecular Properties

Compound NameN-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide
PubChem CID18706907
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC NameN-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide
SMILESCCc1c(-c2ccc(OCc3ccccc3)cc2)cn2cc(NC(C)=O)ccc12
InChIInChI=1S/C25H24N2O2/c1-3-23-24(16-27-15-21(26-18(2)28)11-14-25(23)27)20-9-12-22(13-10-20)29-17-19-7-5-4-6-8-19/h4-16H,3,17H2,1-2H3,(H,26,28)
InChIKeyCNVOZMHPMFCXKG-UHFFFAOYSA-N
XLogP5.71
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

propyl N-(4-phenylmethoxyphenyl)carbamate
CID 19169909
6-ethyl-10-phenylmethoxy-5-(4-phenylmethoxyphenyl)-11-azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaene-2,3-dicarboxylic acid
CID 18706922
1-[6-ethyl-8-(hydroxymethyl)-5-(4-phenylmethoxyphenyl)-11-azatricyclo[5.3.1.04,11]undeca-1,3,5,7,9-pentaen-2-yl]ethanone
CID 18707060
3-(4-phenylmethoxyanilino)but-2-enoic acid
CID 154014909
N-(4-acetylphenyl)-N'-(4-phenylmethoxyphenyl)oxamide
CID 108987469
4-acetyl-N-(4-phenylmethoxyphenyl)piperazine-1-carboxamide
CID 108988713
6-ethyl-8-(hydroxymethyl)-5-(4-phenylmethoxyphenyl)-11-azatricyclo[5.3.1.04,11]undeca-1,3,5,7,9-pentaene-2,3-dicarboxylic acid
CID 18706977
N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide
CID 693499
2-(4-phenylmethoxyanilino)propanoic acid
CID 22078170
[6-ethyl-10-phenylmethoxy-5-(4-phenylmethoxyphenyl)-11-azatricyclo[5.3.1.04,11]undeca-1(10),2,4,6,8-pentaen-3-yl]methanol
CID 18707037
N-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]butanamide
CID 113000427
N-[4-[(3-methylphenyl)methoxy]phenyl]acetamide
CID 8522252

Frequently Asked Questions

What is the IUPAC name of N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide?
The IUPAC name of N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide (CID 18706907) is N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide.
What is the SMILES notation for N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide?
The canonical SMILES for N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide is CCc1c(-c2ccc(OCc3ccccc3)cc2)cn2cc(NC(C)=O)ccc12.
What is the InChIKey of N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide?
The InChIKey is CNVOZMHPMFCXKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-3-23-24(16-27-15-21(26-18(2)28)11-14-25(23)27)20-9-12-22(13-10-20)29-17-19-7-5-4-6-8-19/h4-16H,3,17H2,1-2H3,(H,26,28).
What are the key properties of N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide?
N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide has a molecular weight of 384.48 g/mol, XLogP of 5.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-ethyl-2-(4-phenylmethoxyphenyl)indolizin-6-yl]acetamide is sourced from PubChem (CID 18706907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).