3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide

C15H23N3O3 — CID 46984120

IUPAC3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide
SMILESO=C(CCN1CCCCO1)NCCCOc1cccnc1
InChIInChI=1S/C15H23N3O3/c19-15(6-10-18-9-1-2-12-21-18)17-8-4-11-20-14-5-3-7-16-13-14/h3,5,7,13H,1-2,4,6,8-12H2,(H,17,19)
InChIKeySWHNEEKRIBFEKH-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.38
Rot. Bonds8

About 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide

3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide (PubChem CID 46984120) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide.

Molecular Properties

Compound Name3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide
PubChem CID46984120
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide
SMILESO=C(CCN1CCCCO1)NCCCOc1cccnc1
InChIInChI=1S/C15H23N3O3/c19-15(6-10-18-9-1-2-12-21-18)17-8-4-11-20-14-5-3-7-16-13-14/h3,5,7,13H,1-2,4,6,8-12H2,(H,17,19)
InChIKeySWHNEEKRIBFEKH-UHFFFAOYSA-N
XLogP1.38
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(3S)-oxan-3-yl]-N-(3-pyridin-3-yloxypropyl)acetamide
CID 126425334
3-(3-pyridin-3-yloxypropanoylamino)propanoic acid
CID 110837112
1-morpholin-4-yl-N-(3-pyridin-3-yloxypropyl)cyclohexane-1-carboxamide
CID 118774806
(2R)-2-methyl-N-(3-pyridin-3-yloxypropyl)oxolane-2-carboxamide
CID 126429271
(2S)-2-methyl-N-(3-pyridin-3-yloxypropyl)oxolane-2-carboxamide
CID 126429268
2-(1-hydroxycyclopentyl)-N-(2-pyridin-3-yloxyethyl)acetamide
CID 111538743
2-(1-hydroxycyclohexyl)-N-(2-pyridin-3-yloxyethyl)acetamide
CID 111538742
2-(dimethylamino)-N-(3-pyridin-3-yloxypropyl)propanamide
CID 119060315
N-[5-(azepan-1-yl)pentyl]-4-phenoxybutanamide
CID 110443436
(4S)-4-(dimethylamino)-N-(3-pyridin-3-yloxypropyl)azepane-1-carboxamide
CID 126448105
2-[(1R)-2,3-dihydro-1H-inden-1-yl]-N-(3-pyridin-3-yloxypropyl)acetamide
CID 97116698
1-methyl-5-oxo-N-(3-pyridin-3-yloxypropyl)-4H-1,2,4-triazole-3-carboxamide
CID 156584225

Frequently Asked Questions

What is the IUPAC name of 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide?
The IUPAC name of 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide (CID 46984120) is 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide.
What is the SMILES notation for 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide?
The canonical SMILES for 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide is O=C(CCN1CCCCO1)NCCCOc1cccnc1.
What is the InChIKey of 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide?
The InChIKey is SWHNEEKRIBFEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c19-15(6-10-18-9-1-2-12-21-18)17-8-4-11-20-14-5-3-7-16-13-14/h3,5,7,13H,1-2,4,6,8-12H2,(H,17,19).
What are the key properties of 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide?
3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide has a molecular weight of 293.37 g/mol, XLogP of 1.38, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxazinan-2-yl)-N-(3-pyridin-3-yloxypropyl)propanamide is sourced from PubChem (CID 46984120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).