2-[ethyl(methyl)amino]-1-phenylpropan-1-one

C12H17NO — CID 43794825

IUPAC2-[ethyl(methyl)amino]-1-phenylpropan-1-one
SMILESCCN(C)C(C)C(=O)c1ccccc1
InChIInChI=1S/C12H17NO/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11/h5-10H,4H2,1-3H3
InChIKeyLOQPFJRCXJZNQV-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.21
Rot. Bonds4

About 2-[ethyl(methyl)amino]-1-phenylpropan-1-one

2-[ethyl(methyl)amino]-1-phenylpropan-1-one (PubChem CID 43794825) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]-1-phenylpropan-1-one.

Molecular Properties

Compound Name2-[ethyl(methyl)amino]-1-phenylpropan-1-one
PubChem CID43794825
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-[ethyl(methyl)amino]-1-phenylpropan-1-one
SMILESCCN(C)C(C)C(=O)c1ccccc1
InChIInChI=1S/C12H17NO/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11/h5-10H,4H2,1-3H3
InChIKeyLOQPFJRCXJZNQV-UHFFFAOYSA-N
XLogP2.21
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[ethyl(methyl)amino]-1-(4-fluorophenyl)propan-1-one
CID 43794816
2-[methyl(2-phenylethyl)amino]-1-phenylpropan-1-one
CID 65487247
2-[methyl(pentan-3-yl)amino]-1-phenylpropan-1-one
CID 43796822
2-[ethyl-(1-oxo-1-phenylpropan-2-yl)amino]-N,N-dimethylacetamide
CID 60864172
N-methyl-N-(1-oxo-1-phenylpropan-2-yl)benzamide
CID 11119051
2-[ethyl-(1-oxo-1-phenylpropan-2-yl)amino]acetamide
CID 103103066
propyl N-methyl-N-(1-oxo-1-phenylpropan-2-yl)carbamate
CID 91747711
1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one
CID 43795382
1-(3,4-dimethylphenyl)-2-[ethyl(methyl)amino]propan-1-one
CID 43794892
2-[methyl(2-pyridin-2-ylethyl)amino]-1-phenylpropan-1-one
CID 43228048
N-ethyl-N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide
CID 58597535
2-methyl-3-[methyl(propan-2-yl)amino]-1-phenylpropan-1-one
CID 62611631

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methyl)amino]-1-phenylpropan-1-one?
The IUPAC name of 2-[ethyl(methyl)amino]-1-phenylpropan-1-one (CID 43794825) is 2-[ethyl(methyl)amino]-1-phenylpropan-1-one.
What is the SMILES notation for 2-[ethyl(methyl)amino]-1-phenylpropan-1-one?
The canonical SMILES for 2-[ethyl(methyl)amino]-1-phenylpropan-1-one is CCN(C)C(C)C(=O)c1ccccc1.
What is the InChIKey of 2-[ethyl(methyl)amino]-1-phenylpropan-1-one?
The InChIKey is LOQPFJRCXJZNQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11/h5-10H,4H2,1-3H3.
What are the key properties of 2-[ethyl(methyl)amino]-1-phenylpropan-1-one?
2-[ethyl(methyl)amino]-1-phenylpropan-1-one has a molecular weight of 191.27 g/mol, XLogP of 2.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methyl)amino]-1-phenylpropan-1-one is sourced from PubChem (CID 43794825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).