(2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide

C11H18N2O2 — CID 70415484

IUPAC(2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide
SMILESC[C@H](NC(=O)C(C1CC1)C1CC1)C(N)=O
InChIInChI=1S/C11H18N2O2/c1-6(10(12)14)13-11(15)9(7-2-3-7)8-4-5-8/h6-9H,2-5H2,1H3,(H2,12,14)(H,13,15)/t6-/m0/s1
InChIKeyPSLDMEZTQOTSFX-LURJTMIESA-N
MW210.28 g/mol
LogP0.41
Rot. Bonds5

About (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide

(2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide (PubChem CID 70415484) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide.

Molecular Properties

Compound Name(2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide
PubChem CID70415484
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name(2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide
SMILESC[C@H](NC(=O)C(C1CC1)C1CC1)C(N)=O
InChIInChI=1S/C11H18N2O2/c1-6(10(12)14)13-11(15)9(7-2-3-7)8-4-5-8/h6-9H,2-5H2,1H3,(H2,12,14)(H,13,15)/t6-/m0/s1
InChIKeyPSLDMEZTQOTSFX-LURJTMIESA-N
XLogP0.41
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide?
The IUPAC name of (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide (CID 70415484) is (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide.
What is the SMILES notation for (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide?
The canonical SMILES for (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide is C[C@H](NC(=O)C(C1CC1)C1CC1)C(N)=O.
What is the InChIKey of (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide?
The InChIKey is PSLDMEZTQOTSFX-LURJTMIESA-N. The full InChI is InChI=1S/C11H18N2O2/c1-6(10(12)14)13-11(15)9(7-2-3-7)8-4-5-8/h6-9H,2-5H2,1H3,(H2,12,14)(H,13,15)/t6-/m0/s1.
What are the key properties of (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide?
(2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide has a molecular weight of 210.28 g/mol, XLogP of 0.41, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2,2-dicyclopropylacetyl)amino]propanamide is sourced from PubChem (CID 70415484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).