2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide

C17H28N2O — CID 109006691

IUPAC2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(CC)c1cccc(C)c1
InChIInChI=1S/C17H28N2O/c1-5-11-19(12-6-2)17(20)14-18(7-3)16-10-8-9-15(4)13-16/h8-10,13H,5-7,11-12,14H2,1-4H3
InChIKeyUUZXCWKCXICNFA-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.47
Rot. Bonds8

About 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide

2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide (PubChem CID 109006691) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide
PubChem CID109006691
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(CC)c1cccc(C)c1
InChIInChI=1S/C17H28N2O/c1-5-11-19(12-6-2)17(20)14-18(7-3)16-10-8-9-15(4)13-16/h8-10,13H,5-7,11-12,14H2,1-4H3
InChIKeyUUZXCWKCXICNFA-UHFFFAOYSA-N
XLogP3.47
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide
CID 113167538
3-(N-[2-(diethylamino)-2-oxoethyl]-3-methylanilino)propanoic acid
CID 82316967
1-(N-ethyl-3-methylanilino)pentan-2-one
CID 62044649
2-(3-methyl-N-propylanilino)acetic acid
CID 83559836
2-(N-ethyl-3-methylanilino)-1-(2-methylphenyl)ethanone
CID 61102989
CID 138691667
CID 138691667
1-(N-ethyl-3-methylanilino)-3-methoxypropan-2-one
CID 107507164
3-(3-methyl-N-propylanilino)propanoic acid
CID 82317776
1-cyclopentyl-2-(N-ethyl-3-methylanilino)ethanone
CID 104750103
N,N'-diethyl-N,N'-bis(3-methylphenyl)propane-1,3-diamine
CID 57172568
N-(1,1-dioxothiolan-3-yl)-N-ethyl-2-(N-ethyl-3-methylanilino)acetamide
CID 109003580
N-ethyl-3-(N-ethylanilino)-N-(3-methylphenyl)propanamide
CID 109036586

Frequently Asked Questions

What is the IUPAC name of 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide?
The IUPAC name of 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide (CID 109006691) is 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide.
What is the SMILES notation for 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide?
The canonical SMILES for 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN(CC)c1cccc(C)c1.
What is the InChIKey of 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide?
The InChIKey is UUZXCWKCXICNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-11-19(12-6-2)17(20)14-18(7-3)16-10-8-9-15(4)13-16/h8-10,13H,5-7,11-12,14H2,1-4H3.
What are the key properties of 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide?
2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide has a molecular weight of 276.42 g/mol, XLogP of 3.47, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide is sourced from PubChem (CID 109006691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).