N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide

C14H27N3O3 — CID 56717274

IUPACN-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide
SMILESCN1CCOC(CCNC(=O)CCN2CCCCO2)C1
InChIInChI=1S/C14H27N3O3/c1-16-9-11-19-13(12-16)4-6-15-14(18)5-8-17-7-2-3-10-20-17/h13H,2-12H2,1H3,(H,15,18)
InChIKeyHHBQSBAOUQANNK-UHFFFAOYSA-N
MW285.39 g/mol
LogP0.24
Rot. Bonds6

About N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide

N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide (PubChem CID 56717274) has the molecular formula C14H27N3O3 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide
PubChem CID56717274
Molecular FormulaC14H27N3O3
Molecular Weight285.39 g/mol
Exact Mass285.21
IUPAC NameN-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide
SMILESCN1CCOC(CCNC(=O)CCN2CCCCO2)C1
InChIInChI=1S/C14H27N3O3/c1-16-9-11-19-13(12-16)4-6-15-14(18)5-8-17-7-2-3-10-20-17/h13H,2-12H2,1H3,(H,15,18)
InChIKeyHHBQSBAOUQANNK-UHFFFAOYSA-N
XLogP0.24
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
The IUPAC name of N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide (CID 56717274) is N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide.
What is the SMILES notation for N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
The canonical SMILES for N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide is CN1CCOC(CCNC(=O)CCN2CCCCO2)C1.
What is the InChIKey of N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
The InChIKey is HHBQSBAOUQANNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O3/c1-16-9-11-19-13(12-16)4-6-15-14(18)5-8-17-7-2-3-10-20-17/h13H,2-12H2,1H3,(H,15,18).
What are the key properties of N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide has a molecular weight of 285.39 g/mol, XLogP of 0.24, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylmorpholin-2-yl)ethyl]-3-(oxazinan-2-yl)propanamide is sourced from PubChem (CID 56717274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).