N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide

C9H17N3O3 — CID 63282323

IUPACN-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide
SMILESCCNC(=O)NC(=O)C(C)N1CC(O)C1
InChIInChI=1S/C9H17N3O3/c1-3-10-9(15)11-8(14)6(2)12-4-7(13)5-12/h6-7,13H,3-5H2,1-2H3,(H2,10,11,14,15)
InChIKeyXMKWSCWRQSPGTE-UHFFFAOYSA-N
MW215.25 g/mol
LogP-1.10
Rot. Bonds3

About N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide

N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide (PubChem CID 63282323) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide
PubChem CID63282323
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC NameN-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide
SMILESCCNC(=O)NC(=O)C(C)N1CC(O)C1
InChIInChI=1S/C9H17N3O3/c1-3-10-9(15)11-8(14)6(2)12-4-7(13)5-12/h6-7,13H,3-5H2,1-2H3,(H2,10,11,14,15)
InChIKeyXMKWSCWRQSPGTE-UHFFFAOYSA-N
XLogP-1.10
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(3S,4S)-1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-4-methylpyrrolidine-3-carboxylic acid
CID 114086173
N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide
CID 46614180
N-(ethylcarbamoyl)-2-(3-piperazin-1-ylazetidin-1-yl)propanamide
CID 66196768
2-(3-aminopyrrolidin-1-yl)-N-(ethylcarbamoyl)propanamide;hydrochloride
CID 119917700
N-(ethylcarbamoyl)-2-piperazin-1-ylpropanamide
CID 43089574
(2R)-2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-N-(ethylcarbamoyl)propanamide
CID 11931790
N-(ethylcarbamoyl)-2-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 60638694
2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide
CID 81460901
(2R)-N-(ethylcarbamoyl)-2-(4-ethylsulfonylpiperazin-1-yl)propanamide
CID 94418975
methyl 1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidine-4-carboxylate
CID 60638894
2-[2-(aminomethyl)morpholin-4-yl]-N-(ethylcarbamoyl)propanamide
CID 61338002
2-[3-(2-aminoethyl)piperidin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 63763714

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide (CID 63282323) is N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide is CCNC(=O)NC(=O)C(C)N1CC(O)C1.
What is the InChIKey of N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide?
The InChIKey is XMKWSCWRQSPGTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-3-10-9(15)11-8(14)6(2)12-4-7(13)5-12/h6-7,13H,3-5H2,1-2H3,(H2,10,11,14,15).
What are the key properties of N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide?
N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide has a molecular weight of 215.25 g/mol, XLogP of -1.10, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide is sourced from PubChem (CID 63282323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).