2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one

C14H28N2O3 — CID 103605790

IUPAC2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(C)COCCCNC(C)C(=O)N1CCOCC1
InChIInChI=1S/C14H28N2O3/c1-12(2)11-19-8-4-5-15-13(3)14(17)16-6-9-18-10-7-16/h12-13,15H,4-11H2,1-3H3
InChIKeyPGVWAGWERDURFA-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.89
Rot. Bonds8

About 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one

2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one (PubChem CID 103605790) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one
PubChem CID103605790
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(C)COCCCNC(C)C(=O)N1CCOCC1
InChIInChI=1S/C14H28N2O3/c1-12(2)11-19-8-4-5-15-13(3)14(17)16-6-9-18-10-7-16/h12-13,15H,4-11H2,1-3H3
InChIKeyPGVWAGWERDURFA-UHFFFAOYSA-N
XLogP0.89
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(6-hydroxyhexylamino)-1-morpholin-4-ylpropan-1-one
CID 107703595
2-(3-methylsulfonylpropylamino)-1-morpholin-4-ylpropan-1-one
CID 54905141
1-morpholin-4-yl-2-[3-(propan-2-ylamino)propoxy]ethanone
CID 62342996
2-[2-(tert-butylamino)ethylamino]-1-morpholin-4-ylpropan-1-one
CID 107446064
2-[3-(2-methylpropoxy)propylamino]-N-(2-methylpropyl)propanamide
CID 103604221
N-(2-methoxyethyl)-2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]acetamide
CID 112683464
N,N-diethyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanamide
CID 115588983
1-morpholin-4-yl-2-(2-thiomorpholin-4-ylethylamino)propan-1-one
CID 106325630
2-[2-[cyclopentyl(methyl)amino]ethylamino]-1-morpholin-4-ylpropan-1-one
CID 63318437
2-(2-morpholin-4-ylethylamino)-1-piperidin-1-ylpropan-1-one
CID 43083600
2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid
CID 104645019
2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-1-morpholin-4-ylpropan-1-one
CID 115569816

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one (CID 103605790) is 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one is CC(C)COCCCNC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is PGVWAGWERDURFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-12(2)11-19-8-4-5-15-13(3)14(17)16-6-9-18-10-7-16/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one?
2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 272.39 g/mol, XLogP of 0.89, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methylpropoxy)propylamino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 103605790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).