N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide

C17H24N2O3 — CID 86981316

IUPACN-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide
SMILESCC1(C)CN(C(=O)CCNC(=O)Cc2ccccc2)CCO1
InChIInChI=1S/C17H24N2O3/c1-17(2)13-19(10-11-22-17)16(21)8-9-18-15(20)12-14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,18,20)
InChIKeyLGMNKFJFQKRMNH-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.37
Rot. Bonds5

About N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide

N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide (PubChem CID 86981316) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide
PubChem CID86981316
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide
SMILESCC1(C)CN(C(=O)CCNC(=O)Cc2ccccc2)CCO1
InChIInChI=1S/C17H24N2O3/c1-17(2)13-19(10-11-22-17)16(21)8-9-18-15(20)12-14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,18,20)
InChIKeyLGMNKFJFQKRMNH-UHFFFAOYSA-N
XLogP1.37
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-morpholin-4-yl-3-oxopropyl)-2-phenylacetamide
CID 29418767
N-benzyl-2,2-dimethylmorpholine-4-carboxamide
CID 38286944
1-(2,2-dimethylmorpholin-4-yl)-3-(1H-indol-3-yl)propan-1-one
CID 35017812
N-[3-[4-(methylaminomethyl)piperidin-1-yl]-3-oxopropyl]-2-phenylacetamide
CID 119542661
N-[3-[4-(N-methylanilino)piperidin-1-yl]-3-oxopropyl]-2-phenylacetamide
CID 136578286
(2S)-2-amino-1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-1-one;hydrochloride
CID 119294272
N-[3-[4-(1-aminoethyl)piperidin-1-yl]-3-oxopropyl]-2-phenylacetamide
CID 119516744
3-bromo-N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]benzenesulfonamide
CID 55657452
1-(2,2-dimethylmorpholin-4-yl)-4-(methylamino)butan-1-one;hydrochloride
CID 119732360
N-[3-[4-(ethylaminomethyl)piperidin-1-yl]-3-oxopropyl]-2-phenylacetamide;hydrochloride
CID 119644211
N-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]propanamide
CID 110287317
2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide
CID 38290092

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide?
The IUPAC name of N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide (CID 86981316) is N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide.
What is the SMILES notation for N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide?
The canonical SMILES for N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide is CC1(C)CN(C(=O)CCNC(=O)Cc2ccccc2)CCO1.
What is the InChIKey of N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide?
The InChIKey is LGMNKFJFQKRMNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-17(2)13-19(10-11-22-17)16(21)8-9-18-15(20)12-14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,18,20).
What are the key properties of N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide?
N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide has a molecular weight of 304.39 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,2-dimethylmorpholin-4-yl)-3-oxopropyl]-2-phenylacetamide is sourced from PubChem (CID 86981316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).