3-amino-1-morpholin-4-ylpropan-1-one

C7H14N2O2 — CID 6504250

IUPAC3-amino-1-morpholin-4-ylpropan-1-one
SMILESNCCC(=O)N1CCOCC1
InChIInChI=1S/C7H14N2O2/c8-2-1-7(10)9-3-5-11-6-4-9/h1-6,8H2
InChIKeyWVFZXCIIJBHBAA-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.81
Rot. Bonds2

About 3-amino-1-morpholin-4-ylpropan-1-one

3-amino-1-morpholin-4-ylpropan-1-one (PubChem CID 6504250) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 3-amino-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name3-amino-1-morpholin-4-ylpropan-1-one
PubChem CID6504250
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name3-amino-1-morpholin-4-ylpropan-1-one
SMILESNCCC(=O)N1CCOCC1
InChIInChI=1S/C7H14N2O2/c8-2-1-7(10)9-3-5-11-6-4-9/h1-6,8H2
InChIKeyWVFZXCIIJBHBAA-UHFFFAOYSA-N
XLogP-0.81
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Morpholin-4-yl)-3-oxopropanethioamide
CID 1493878
N-(2-cyanoethyl)-3-morpholinopropanamide
CID 657480
3-Morpholinopropanamide
CID 840039
1-(2-(Aminomethyl)morpholino)ethanone
CID 10607034
3-Morpholin-4-ylpropanamide;hydrochloride
CID 21458801
3-amino-N-(2-methoxyethyl)propanamide
CID 16783560
3-Amino-1-(morpholin-4-yl)propan-1-one hydrochloride
CID 16281137
N-methyl-3-morpholin-4-ylpropanamide;hydrochloride
CID 45264777
2-methyl-N-(3-morpholin-4-ylpropyl)propanamide
CID 2234916
2,2-dimethyl-N-[3-(morpholin-4-yl)propyl]propanamide
CID 3107364
N-(morpholin-2-ylmethyl)acetamide
CID 10241064
N-methyl-3-morpholin-4-ylpropanamide
CID 21035093

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 3-amino-1-morpholin-4-ylpropan-1-one (CID 6504250) is 3-amino-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 3-amino-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 3-amino-1-morpholin-4-ylpropan-1-one is NCCC(=O)N1CCOCC1.
What is the InChIKey of 3-amino-1-morpholin-4-ylpropan-1-one?
The InChIKey is WVFZXCIIJBHBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c8-2-1-7(10)9-3-5-11-6-4-9/h1-6,8H2.
What are the key properties of 3-amino-1-morpholin-4-ylpropan-1-one?
3-amino-1-morpholin-4-ylpropan-1-one has a molecular weight of 158.20 g/mol, XLogP of -0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 6504250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).