N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide

C9H18N2O2 — CID 107218668

IUPACN-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide
SMILESC[C@H](CO)NC(=O)CC1CCNC1
InChIInChI=1S/C9H18N2O2/c1-7(6-12)11-9(13)4-8-2-3-10-5-8/h7-8,10,12H,2-6H2,1H3,(H,11,13)/t7-,8?/m1/s1
InChIKeyNCPVGWIIVDKWQW-GVHYBUMESA-N
MW186.25 g/mol
LogP-0.52
Rot. Bonds4

About N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide

N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide (PubChem CID 107218668) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide
PubChem CID107218668
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide
SMILESC[C@H](CO)NC(=O)CC1CCNC1
InChIInChI=1S/C9H18N2O2/c1-7(6-12)11-9(13)4-8-2-3-10-5-8/h7-8,10,12H,2-6H2,1H3,(H,11,13)/t7-,8?/m1/s1
InChIKeyNCPVGWIIVDKWQW-GVHYBUMESA-N
XLogP-0.52
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-(1-hydroxypropan-2-yl)acetamide
CID 64616757
N-(4-hydroxybutan-2-yl)-2-piperidin-4-ylacetamide
CID 83177313
(2R)-3-hydroxy-2-[(2-pyrrolidin-3-ylacetyl)amino]propanoic acid
CID 80750139
N-(1-hydroxy-4-methylpentan-3-yl)-2-pyrrolidin-3-ylacetamide
CID 104954772
N-(4-methylpentan-2-yl)-2-piperidin-4-ylacetamide
CID 43372444
N-[(2S)-1-hydroxypropan-2-yl]-2-piperidin-4-ylsulfanylacetamide
CID 107219108
N-(1-hydroxypropan-2-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114626594
(2S)-2-[[(3S)-pyrrolidin-3-yl]methylamino]propan-1-ol;sulfane
CID 160904644
N-octan-2-yl-2-piperidin-4-ylacetamide
CID 54910396
N-(2-methylpropoxy)-2-pyrrolidin-3-ylacetamide
CID 82721934
2-methyl-6-[(2-piperidin-3-ylacetyl)amino]heptanoic acid
CID 65285664
2-(azetidin-3-yl)-N-propan-2-ylacetamide
CID 64616125

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide?
The IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide (CID 107218668) is N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide.
What is the SMILES notation for N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide?
The canonical SMILES for N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide is C[C@H](CO)NC(=O)CC1CCNC1.
What is the InChIKey of N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide?
The InChIKey is NCPVGWIIVDKWQW-GVHYBUMESA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7(6-12)11-9(13)4-8-2-3-10-5-8/h7-8,10,12H,2-6H2,1H3,(H,11,13)/t7-,8?/m1/s1.
What are the key properties of N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide?
N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide has a molecular weight of 186.25 g/mol, XLogP of -0.52, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 107218668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).