2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide

C20H26N2O2 — CID 16928268

IUPAC2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide
SMILESCCC(CC)C(=O)NCC(c1ccc(OC)cc1)c1ccccn1
InChIInChI=1S/C20H26N2O2/c1-4-15(5-2)20(23)22-14-18(19-8-6-7-13-21-19)16-9-11-17(24-3)12-10-16/h6-13,15,18H,4-5,14H2,1-3H3,(H,22,23)
InChIKeyOVMVZSXYTGAQGR-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.77
Rot. Bonds8

About 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide

2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide (PubChem CID 16928268) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide
PubChem CID16928268
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide
SMILESCCC(CC)C(=O)NCC(c1ccc(OC)cc1)c1ccccn1
InChIInChI=1S/C20H26N2O2/c1-4-15(5-2)20(23)22-14-18(19-8-6-7-13-21-19)16-9-11-17(24-3)12-10-16/h6-13,15,18H,4-5,14H2,1-3H3,(H,22,23)
InChIKeyOVMVZSXYTGAQGR-UHFFFAOYSA-N
XLogP3.77
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]carbamate
CID 16928325
N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]thiophene-2-carboxamide
CID 16928294
N-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-2-pyridin-2-ylacetamide
CID 110373640
methyl N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]carbamate
CID 16927927
N-(2-phenyl-2-pyridin-2-ylethyl)acetamide
CID 16927789
1-(4-methoxyphenyl)-1-pyridin-2-ylpropan-2-one
CID 174924212
N-(4-methoxyphenyl)-2-phenyl-2-pyridin-2-ylacetamide
CID 110373398
3-[2-(4-fluorophenyl)-2-pyridin-2-ylethyl]-1,1-dimethylurea
CID 110362940
2,2-dimethyl-N-(2-phenyl-2-pyridin-2-ylethyl)propanamide
CID 16927739
[2-(4-chlorophenyl)-2-pyridin-2-ylethyl]carbamic acid
CID 155128689
2-ethyl-N-(pyridin-2-ylmethyl)butanamide
CID 5055685
N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]pentanamide
CID 16927840

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide?
The IUPAC name of 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide (CID 16928268) is 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide?
The canonical SMILES for 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide is CCC(CC)C(=O)NCC(c1ccc(OC)cc1)c1ccccn1.
What is the InChIKey of 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide?
The InChIKey is OVMVZSXYTGAQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-4-15(5-2)20(23)22-14-18(19-8-6-7-13-21-19)16-9-11-17(24-3)12-10-16/h6-13,15,18H,4-5,14H2,1-3H3,(H,22,23).
What are the key properties of 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide?
2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide has a molecular weight of 326.44 g/mol, XLogP of 3.77, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(4-methoxyphenyl)-2-pyridin-2-ylethyl]butanamide is sourced from PubChem (CID 16928268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).