2-hydroxy-3-(3-propylazetidin-1-yl)propanamide

C9H18N2O2 — CID 106172316

IUPAC2-hydroxy-3-(3-propylazetidin-1-yl)propanamide
SMILESCCCC1CN(CC(O)C(N)=O)C1
InChIInChI=1S/C9H18N2O2/c1-2-3-7-4-11(5-7)6-8(12)9(10)13/h7-8,12H,2-6H2,1H3,(H2,10,13)
InChIKeyTYEWWZIVIXBWNK-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.44
Rot. Bonds5

About 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide

2-hydroxy-3-(3-propylazetidin-1-yl)propanamide (PubChem CID 106172316) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide.

Molecular Properties

Compound Name2-hydroxy-3-(3-propylazetidin-1-yl)propanamide
PubChem CID106172316
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-hydroxy-3-(3-propylazetidin-1-yl)propanamide
SMILESCCCC1CN(CC(O)C(N)=O)C1
InChIInChI=1S/C9H18N2O2/c1-2-3-7-4-11(5-7)6-8(12)9(10)13/h7-8,12H,2-6H2,1H3,(H2,10,13)
InChIKeyTYEWWZIVIXBWNK-UHFFFAOYSA-N
XLogP-0.44
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-3-(3-methylazetidin-1-yl)propanamide
CID 106172308
1-cyclopropyl-2-(3-propylazetidin-1-yl)ethanol
CID 104549602
1-(3-propylazetidin-1-yl)butan-2-amine
CID 79678155
3-[(3-propylazetidin-1-yl)methyl]pentan-1-ol
CID 104550573
3-methyl-4-(3-propylazetidin-1-yl)butan-1-ol
CID 104550305
(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide
CID 139994920
2-(3-amino-5-propylpiperidin-1-yl)acetamide
CID 83989452
2-hydroxybutanamide;hydrochloride
CID 87384831
6-(3-propylazetidin-1-yl)hexanoic acid
CID 79686619
2-[(3-propylazetidin-1-yl)methyl]cyclohexane-1-carboxylic acid
CID 79688129
ethyl 3-(3-aminoazetidin-1-yl)-2-methylpropanoate
CID 65250331
2-(3-propylazetidin-1-yl)pentanoic acid
CID 79695238

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide?
The IUPAC name of 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide (CID 106172316) is 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide.
What is the SMILES notation for 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide?
The canonical SMILES for 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide is CCCC1CN(CC(O)C(N)=O)C1.
What is the InChIKey of 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide?
The InChIKey is TYEWWZIVIXBWNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-2-3-7-4-11(5-7)6-8(12)9(10)13/h7-8,12H,2-6H2,1H3,(H2,10,13).
What are the key properties of 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide?
2-hydroxy-3-(3-propylazetidin-1-yl)propanamide has a molecular weight of 186.25 g/mol, XLogP of -0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(3-propylazetidin-1-yl)propanamide is sourced from PubChem (CID 106172316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).