2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide

C15H23N3O2 — CID 113160477

IUPAC2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide
SMILESCC(=O)N(CCN(C)C)CC(=O)N(C)c1ccccc1
InChIInChI=1S/C15H23N3O2/c1-13(19)18(11-10-16(2)3)12-15(20)17(4)14-8-6-5-7-9-14/h5-9H,10-12H2,1-4H3
InChIKeyTZNHDZSBXOWOSY-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.06
Rot. Bonds6

About 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide

2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide (PubChem CID 113160477) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide
PubChem CID113160477
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide
SMILESCC(=O)N(CCN(C)C)CC(=O)N(C)c1ccccc1
InChIInChI=1S/C15H23N3O2/c1-13(19)18(11-10-16(2)3)12-15(20)17(4)14-8-6-5-7-9-14/h5-9H,10-12H2,1-4H3
InChIKeyTZNHDZSBXOWOSY-UHFFFAOYSA-N
XLogP1.06
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[acetyl(3-methoxypropyl)amino]-N-methyl-N-phenylacetamide
CID 113160082
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-methyl-N-phenylacetamide
CID 113165999
2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-phenylacetamide
CID 113160473
2-[acetyl(cyclopropyl)amino]-N-methyl-N-phenylacetamide
CID 113158391
3-[acetyl(3-phenylpropyl)amino]-N-methyl-N-phenylpropanamide
CID 113122262
3-[acetyl-[2-(dimethylamino)ethyl]amino]-N-benzyl-N-phenylpropanamide
CID 113117602
2-[methyl-[2-(N-methylanilino)-2-oxoethyl]amino]acetic acid
CID 43442375
2-[bis(2-chloroethyl)amino]-N-methyl-N-phenylacetamide
CID 15344
N-benzyl-N-[2-(dimethylamino)ethyl]-3-oxobutanamide
CID 54876796
2-(N-acetyl-4-ethylanilino)-N-methyl-N-phenylacetamide
CID 113169298
2-methyl-2-[methyl-[2-(N-methylanilino)-2-oxoethyl]amino]propanoic acid
CID 62822694
3-(N-acetyl-4-bromoanilino)-N-methyl-N-phenylpropanamide
CID 113128623

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide (CID 113160477) is 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide is CC(=O)N(CCN(C)C)CC(=O)N(C)c1ccccc1.
What is the InChIKey of 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide?
The InChIKey is TZNHDZSBXOWOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-13(19)18(11-10-16(2)3)12-15(20)17(4)14-8-6-5-7-9-14/h5-9H,10-12H2,1-4H3.
What are the key properties of 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide?
2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide has a molecular weight of 277.37 g/mol, XLogP of 1.06, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 113160477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).