N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide

C9H17N3O3 — CID 115758780

IUPACN-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide
SMILESCNC(=O)C(C)NC(=O)NC1CCOC1
InChIInChI=1S/C9H17N3O3/c1-6(8(13)10-2)11-9(14)12-7-3-4-15-5-7/h6-7H,3-5H2,1-2H3,(H,10,13)(H2,11,12,14)
InChIKeyQZIXFDYSMZTTDU-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.79
Rot. Bonds3

About N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide

N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide (PubChem CID 115758780) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide
PubChem CID115758780
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC NameN-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide
SMILESCNC(=O)C(C)NC(=O)NC1CCOC1
InChIInChI=1S/C9H17N3O3/c1-6(8(13)10-2)11-9(14)12-7-3-4-15-5-7/h6-7H,3-5H2,1-2H3,(H,10,13)(H2,11,12,14)
InChIKeyQZIXFDYSMZTTDU-UHFFFAOYSA-N
XLogP-0.79
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclopropylethyl)-3-(oxolan-3-yl)urea
CID 115758248
1-but-3-en-2-yl-3-(oxolan-3-yl)urea
CID 115759178
4-[[1-(methylamino)-1-oxopropan-2-yl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 61465769
N-cyclopropyl-2-(cyclopropylcarbamoylamino)propanamide
CID 116657682
(2S)-N-methyl-2-(oxan-3-ylamino)propanamide
CID 130727521
N-cyclopropyl-2-(oxolan-3-ylamino)propanamide
CID 80713366
1-hexan-3-yl-3-(oxolan-3-yl)urea
CID 115759008
1-[1-(2-methylphenyl)ethyl]-3-(oxolan-3-yl)urea
CID 113322035
1-(oxolan-3-yl)-3-(1-pyridin-4-ylethyl)urea
CID 115758270
1-cyclopentyl-3-(oxolan-3-yl)urea
CID 115758222
1-tert-butyl-3-(oxolan-3-yl)urea
CID 115755738
1-(1-hydroxy-4,4-dimethylpentan-3-yl)-3-(oxolan-3-yl)urea
CID 104929916

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide?
The IUPAC name of N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide (CID 115758780) is N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide.
What is the SMILES notation for N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide?
The canonical SMILES for N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide is CNC(=O)C(C)NC(=O)NC1CCOC1.
What is the InChIKey of N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide?
The InChIKey is QZIXFDYSMZTTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-6(8(13)10-2)11-9(14)12-7-3-4-15-5-7/h6-7H,3-5H2,1-2H3,(H,10,13)(H2,11,12,14).
What are the key properties of N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide?
N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide has a molecular weight of 215.25 g/mol, XLogP of -0.79, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-ylcarbamoylamino)propanamide is sourced from PubChem (CID 115758780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).