2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide

C8H16N2O — CID 131206831

IUPAC2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide
SMILESCC[C@@H]1C[C@H]1NC(C)C(N)=O
InChIInChI=1S/C8H16N2O/c1-3-6-4-7(6)10-5(2)8(9)11/h5-7,10H,3-4H2,1-2H3,(H2,9,11)/t5?,6-,7-/m1/s1
InChIKeyAUDIWEUGANSFCH-JXBXZBNISA-N
MW156.23 g/mol
LogP0.25
Rot. Bonds4

About 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide

2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide (PubChem CID 131206831) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide.

Molecular Properties

Compound Name2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide
PubChem CID131206831
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide
SMILESCC[C@@H]1C[C@H]1NC(C)C(N)=O
InChIInChI=1S/C8H16N2O/c1-3-6-4-7(6)10-5(2)8(9)11/h5-7,10H,3-4H2,1-2H3,(H2,9,11)/t5?,6-,7-/m1/s1
InChIKeyAUDIWEUGANSFCH-JXBXZBNISA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide?
The IUPAC name of 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide (CID 131206831) is 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide.
What is the SMILES notation for 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide?
The canonical SMILES for 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide is CC[C@@H]1C[C@H]1NC(C)C(N)=O.
What is the InChIKey of 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide?
The InChIKey is AUDIWEUGANSFCH-JXBXZBNISA-N. The full InChI is InChI=1S/C8H16N2O/c1-3-6-4-7(6)10-5(2)8(9)11/h5-7,10H,3-4H2,1-2H3,(H2,9,11)/t5?,6-,7-/m1/s1.
What are the key properties of 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide?
2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide has a molecular weight of 156.23 g/mol, XLogP of 0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R,2R)-2-ethylcyclopropyl]amino]propanamide is sourced from PubChem (CID 131206831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).