1-(methylamino)-3-phenylmethoxypropan-2-one

C11H15NO2 — CID 143048834

IUPAC1-(methylamino)-3-phenylmethoxypropan-2-one
SMILESCNCC(=O)COCc1ccccc1
InChIInChI=1S/C11H15NO2/c1-12-7-11(13)9-14-8-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3
InChIKeyNPLCVWMIOFSSPU-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.99
Rot. Bonds6

About 1-(methylamino)-3-phenylmethoxypropan-2-one

1-(methylamino)-3-phenylmethoxypropan-2-one (PubChem CID 143048834) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(methylamino)-3-phenylmethoxypropan-2-one.

Molecular Properties

Compound Name1-(methylamino)-3-phenylmethoxypropan-2-one
PubChem CID143048834
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1-(methylamino)-3-phenylmethoxypropan-2-one
SMILESCNCC(=O)COCc1ccccc1
InChIInChI=1S/C11H15NO2/c1-12-7-11(13)9-14-8-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3
InChIKeyNPLCVWMIOFSSPU-UHFFFAOYSA-N
XLogP0.99
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(methylamino)-3-phenylmethoxypropan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 3-oxo-4-phenylmethoxybutanoate
CID 12768799
N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide
CID 119501823
tert-butyl 3-oxo-4-phenylmethoxybutanoate
CID 12035485
5,5-dimethyl-1-phenylmethoxyhexan-2-one
CID 131052640
2-(methylamino)-N-(2-methyl-3-phenylmethoxypropyl)acetamide
CID 119750653
4-methylidene-1-phenylmethoxyheptan-2-one
CID 163622001
acetic acid;phenylmethoxymethylbenzene
CID 175214238
N-methylmethanamine;phenylmethoxymethylbenzene
CID 70181699
5-methoxy-1-phenylmethoxypentan-2-one
CID 130933829
2-(methylamino)-N-(1-phenylmethoxypropan-2-yl)acetamide;hydrochloride
CID 119804051
sodium;hydride;2-phenylmethoxyacetic acid
CID 174345523
3-methyl-1-phenylmethoxybutan-2-one
CID 22953611

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-3-phenylmethoxypropan-2-one?
The IUPAC name of 1-(methylamino)-3-phenylmethoxypropan-2-one (CID 143048834) is 1-(methylamino)-3-phenylmethoxypropan-2-one.
What is the SMILES notation for 1-(methylamino)-3-phenylmethoxypropan-2-one?
The canonical SMILES for 1-(methylamino)-3-phenylmethoxypropan-2-one is CNCC(=O)COCc1ccccc1.
What is the InChIKey of 1-(methylamino)-3-phenylmethoxypropan-2-one?
The InChIKey is NPLCVWMIOFSSPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-12-7-11(13)9-14-8-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3.
What are the key properties of 1-(methylamino)-3-phenylmethoxypropan-2-one?
1-(methylamino)-3-phenylmethoxypropan-2-one has a molecular weight of 193.25 g/mol, XLogP of 0.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-3-phenylmethoxypropan-2-one is sourced from PubChem (CID 143048834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).