3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide

C7H15N3O2 — CID 43553568

IUPAC3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
SMILESCCNC(=O)CNCCC(N)=O
InChIInChI=1S/C7H15N3O2/c1-2-10-7(12)5-9-4-3-6(8)11/h9H,2-5H2,1H3,(H2,8,11)(H,10,12)
InChIKeyAFLNQTSQGOGCLC-UHFFFAOYSA-N
MW173.22 g/mol
LogP-1.41
Rot. Bonds6

About 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide

3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide (PubChem CID 43553568) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide.

Molecular Properties

Compound Name3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
PubChem CID43553568
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
SMILESCCNC(=O)CNCCC(N)=O
InChIInChI=1S/C7H15N3O2/c1-2-10-7(12)5-9-4-3-6(8)11/h9H,2-5H2,1H3,(H2,8,11)(H,10,12)
InChIKeyAFLNQTSQGOGCLC-UHFFFAOYSA-N
XLogP-1.41
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-1.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(ethylamino)-2-oxoethyl]amino]-N,N-dimethylpropanamide
CID 60961205
ethane;3-(ethylamino)propanamide
CID 156743022
N-ethyl-2-(pentylamino)acetamide
CID 28569032
N-cyclopropyl-3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
CID 62626302
N'-ethylnonanediamide
CID 18377762
N'-ethyldodecanediamide
CID 175230920
N-ethyl-2-(2-methoxyethylamino)acetamide
CID 28565523
N-ethyl-2-(4-hydroxypentylamino)acetamide
CID 106131847
N-ethyl-2-(3,3,3-trifluoropropylamino)acetamide
CID 60695542
N-ethyl-2-(2-propoxyethylamino)acetamide
CID 106451657
N,N'-diethylpropanediamide
CID 4600245
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 62325687

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide?
The IUPAC name of 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide (CID 43553568) is 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide.
What is the SMILES notation for 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide?
The canonical SMILES for 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide is CCNC(=O)CNCCC(N)=O.
What is the InChIKey of 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide?
The InChIKey is AFLNQTSQGOGCLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2/c1-2-10-7(12)5-9-4-3-6(8)11/h9H,2-5H2,1H3,(H2,8,11)(H,10,12).
What are the key properties of 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide?
3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide has a molecular weight of 173.22 g/mol, XLogP of -1.41, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide is sourced from PubChem (CID 43553568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).