2-[[2-(cyclopropylamino)acetyl]amino]propanamide

C8H15N3O2 — CID 60842858

IUPAC2-[[2-(cyclopropylamino)acetyl]amino]propanamide
SMILESCC(NC(=O)CNC1CC1)C(N)=O
InChIInChI=1S/C8H15N3O2/c1-5(8(9)13)11-7(12)4-10-6-2-3-6/h5-6,10H,2-4H2,1H3,(H2,9,13)(H,11,12)
InChIKeySGCRAULVRYJGKF-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.27
Rot. Bonds5

About 2-[[2-(cyclopropylamino)acetyl]amino]propanamide

2-[[2-(cyclopropylamino)acetyl]amino]propanamide (PubChem CID 60842858) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-[[2-(cyclopropylamino)acetyl]amino]propanamide.

Molecular Properties

Compound Name2-[[2-(cyclopropylamino)acetyl]amino]propanamide
PubChem CID60842858
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name2-[[2-(cyclopropylamino)acetyl]amino]propanamide
SMILESCC(NC(=O)CNC1CC1)C(N)=O
InChIInChI=1S/C8H15N3O2/c1-5(8(9)13)11-7(12)4-10-6-2-3-6/h5-6,10H,2-4H2,1H3,(H2,9,13)(H,11,12)
InChIKeySGCRAULVRYJGKF-UHFFFAOYSA-N
XLogP-1.27
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(cyclopropylamino)acetyl]amino]propanamide?
The IUPAC name of 2-[[2-(cyclopropylamino)acetyl]amino]propanamide (CID 60842858) is 2-[[2-(cyclopropylamino)acetyl]amino]propanamide.
What is the SMILES notation for 2-[[2-(cyclopropylamino)acetyl]amino]propanamide?
The canonical SMILES for 2-[[2-(cyclopropylamino)acetyl]amino]propanamide is CC(NC(=O)CNC1CC1)C(N)=O.
What is the InChIKey of 2-[[2-(cyclopropylamino)acetyl]amino]propanamide?
The InChIKey is SGCRAULVRYJGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-5(8(9)13)11-7(12)4-10-6-2-3-6/h5-6,10H,2-4H2,1H3,(H2,9,13)(H,11,12).
What are the key properties of 2-[[2-(cyclopropylamino)acetyl]amino]propanamide?
2-[[2-(cyclopropylamino)acetyl]amino]propanamide has a molecular weight of 185.23 g/mol, XLogP of -1.27, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(cyclopropylamino)acetyl]amino]propanamide is sourced from PubChem (CID 60842858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).