2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide

C18H28N2O2 — CID 113164026

IUPAC2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(CCc1ccccc1)C(C)=O
InChIInChI=1S/C18H28N2O2/c1-4-12-19(13-5-2)18(22)15-20(16(3)21)14-11-17-9-7-6-8-10-17/h6-10H,4-5,11-15H2,1-3H3
InChIKeyKARUFAYMLDYNFH-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.73
Rot. Bonds9

About 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide

2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide (PubChem CID 113164026) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide
PubChem CID113164026
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(CCc1ccccc1)C(C)=O
InChIInChI=1S/C18H28N2O2/c1-4-12-19(13-5-2)18(22)15-20(16(3)21)14-11-17-9-7-6-8-10-17/h6-10H,4-5,11-15H2,1-3H3
InChIKeyKARUFAYMLDYNFH-UHFFFAOYSA-N
XLogP2.73
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[acetyl(2-phenylethyl)amino]-N,N-diethylpropanamide
CID 113120794
2-[acetyl(propyl)amino]-N-benzyl-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 4245533
N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide
CID 111122043
benzyl N-(2-phenylethyl)-N-propylcarbamate
CID 141214561
3-[butanoyl(2-phenylethyl)amino]propanoic acid
CID 82323377
N-(methoxymethyl)-N-(2-phenylethyl)acetamide
CID 102037583
N-(2-aminoethyl)-3-phenyl-N-propylpropanamide
CID 61348391
N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide
CID 113164087
2-[[2-[acetyl(2-phenylethyl)amino]acetyl]amino]butanoic acid
CID 120523315
N-(2-aminoethyl)-N-(2-phenylethyl)propanamide
CID 120884412
2-[acetyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-N-benzyl-N-ethylacetamide
CID 113165331
2-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]-N-ethyl-N-phenylacetamide
CID 113164876

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide?
The IUPAC name of 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide (CID 113164026) is 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide?
The canonical SMILES for 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN(CCc1ccccc1)C(C)=O.
What is the InChIKey of 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide?
The InChIKey is KARUFAYMLDYNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-4-12-19(13-5-2)18(22)15-20(16(3)21)14-11-17-9-7-6-8-10-17/h6-10H,4-5,11-15H2,1-3H3.
What are the key properties of 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide?
2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide has a molecular weight of 304.43 g/mol, XLogP of 2.73, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide is sourced from PubChem (CID 113164026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).