2-hydroxy-3-(2-methylpropylamino)propanamide

C7H16N2O2 — CID 106171104

IUPAC2-hydroxy-3-(2-methylpropylamino)propanamide
SMILESCC(C)CNCC(O)C(N)=O
InChIInChI=1S/C7H16N2O2/c1-5(2)3-9-4-6(10)7(8)11/h5-6,9-10H,3-4H2,1-2H3,(H2,8,11)
InChIKeyPUJWQZHRDLLCJP-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.92
Rot. Bonds5

About 2-hydroxy-3-(2-methylpropylamino)propanamide

2-hydroxy-3-(2-methylpropylamino)propanamide (PubChem CID 106171104) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-hydroxy-3-(2-methylpropylamino)propanamide.

Molecular Properties

Compound Name2-hydroxy-3-(2-methylpropylamino)propanamide
PubChem CID106171104
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name2-hydroxy-3-(2-methylpropylamino)propanamide
SMILESCC(C)CNCC(O)C(N)=O
InChIInChI=1S/C7H16N2O2/c1-5(2)3-9-4-6(10)7(8)11/h5-6,9-10H,3-4H2,1-2H3,(H2,8,11)
InChIKeyPUJWQZHRDLLCJP-UHFFFAOYSA-N
XLogP-0.92
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(2-methylpropylamino)propanamide?
The IUPAC name of 2-hydroxy-3-(2-methylpropylamino)propanamide (CID 106171104) is 2-hydroxy-3-(2-methylpropylamino)propanamide.
What is the SMILES notation for 2-hydroxy-3-(2-methylpropylamino)propanamide?
The canonical SMILES for 2-hydroxy-3-(2-methylpropylamino)propanamide is CC(C)CNCC(O)C(N)=O.
What is the InChIKey of 2-hydroxy-3-(2-methylpropylamino)propanamide?
The InChIKey is PUJWQZHRDLLCJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-5(2)3-9-4-6(10)7(8)11/h5-6,9-10H,3-4H2,1-2H3,(H2,8,11).
What are the key properties of 2-hydroxy-3-(2-methylpropylamino)propanamide?
2-hydroxy-3-(2-methylpropylamino)propanamide has a molecular weight of 160.22 g/mol, XLogP of -0.92, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(2-methylpropylamino)propanamide is sourced from PubChem (CID 106171104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).