6-(3-aminopropyl)morpholin-3-one

C7H14N2O2 — CID 115060325

IUPAC6-(3-aminopropyl)morpholin-3-one
SMILESNCCCC1CNC(=O)CO1
InChIInChI=1S/C7H14N2O2/c8-3-1-2-6-4-9-7(10)5-11-6/h6H,1-5,8H2,(H,9,10)
InChIKeyHFQLDSDNPZYMKE-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.76
Rot. Bonds3

About 6-(3-aminopropyl)morpholin-3-one

6-(3-aminopropyl)morpholin-3-one (PubChem CID 115060325) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 6-(3-aminopropyl)morpholin-3-one.

Molecular Properties

Compound Name6-(3-aminopropyl)morpholin-3-one
PubChem CID115060325
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name6-(3-aminopropyl)morpholin-3-one
SMILESNCCCC1CNC(=O)CO1
InChIInChI=1S/C7H14N2O2/c8-3-1-2-6-4-9-7(10)5-11-6/h6H,1-5,8H2,(H,9,10)
InChIKeyHFQLDSDNPZYMKE-UHFFFAOYSA-N
XLogP-0.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(aminomethyl)morpholin-3-one;hydrochloride
CID 22612261
6-ethylmorpholin-3-one
CID 77393291
2-(5-oxomorpholin-2-yl)acetic acid
CID 83815625
6-(ethylaminomethyl)morpholin-3-one
CID 105430931
3-[(2R)-morpholin-2-yl]propan-1-amine
CID 92954644
6-[(4-methylidenepiperidin-1-yl)methyl]morpholin-3-one
CID 175647969
6-(thiolan-2-ylmethyl)morpholin-3-one
CID 117159101
6-(furan-2-ylmethyl)morpholin-3-one
CID 117159245
6-(difluoromethyl)morpholin-3-one
CID 178200561
6-(3-aminopropyl)-4-propylmorpholin-3-one
CID 115060329
6-[(1,1-dioxothiolan-3-yl)methyl]morpholin-3-one
CID 117159031
6-(3-aminopropyl)-4-(4-fluorophenyl)morpholin-3-one
CID 115060310

Frequently Asked Questions

What is the IUPAC name of 6-(3-aminopropyl)morpholin-3-one?
The IUPAC name of 6-(3-aminopropyl)morpholin-3-one (CID 115060325) is 6-(3-aminopropyl)morpholin-3-one.
What is the SMILES notation for 6-(3-aminopropyl)morpholin-3-one?
The canonical SMILES for 6-(3-aminopropyl)morpholin-3-one is NCCCC1CNC(=O)CO1.
What is the InChIKey of 6-(3-aminopropyl)morpholin-3-one?
The InChIKey is HFQLDSDNPZYMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c8-3-1-2-6-4-9-7(10)5-11-6/h6H,1-5,8H2,(H,9,10).
What are the key properties of 6-(3-aminopropyl)morpholin-3-one?
6-(3-aminopropyl)morpholin-3-one has a molecular weight of 158.20 g/mol, XLogP of -0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminopropyl)morpholin-3-one is sourced from PubChem (CID 115060325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).