N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide

C10H20N2O2 — CID 94784934

IUPACN-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide
SMILESCOC[C@H](C)NC(=O)CN1CCCC1
InChIInChI=1S/C10H20N2O2/c1-9(8-14-2)11-10(13)7-12-5-3-4-6-12/h9H,3-8H2,1-2H3,(H,11,13)/t9-/m0/s1
InChIKeyKMBFBOCVAJXMPZ-VIFPVBQESA-N
MW200.28 g/mol
LogP0.23
Rot. Bonds5

About N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide

N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide (PubChem CID 94784934) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide
PubChem CID94784934
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide
SMILESCOC[C@H](C)NC(=O)CN1CCCC1
InChIInChI=1S/C10H20N2O2/c1-9(8-14-2)11-10(13)7-12-5-3-4-6-12/h9H,3-8H2,1-2H3,(H,11,13)/t9-/m0/s1
InChIKeyKMBFBOCVAJXMPZ-VIFPVBQESA-N
XLogP0.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[4-[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 134045413
2-[4-(2-amino-2-sulfanylideneethyl)piperazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 63336209
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 55261186
2-[4-(3-aminopropyl)piperazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 61488098
N-(1-methoxypropan-2-yl)-2-[4-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
CID 63853257
2-[4-(1-amino-1-sulfanylidenepropan-2-yl)piperazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 63341913
2-(3-aminoazetidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
CID 63761326
N-(1-methoxypropan-2-yl)-2-(3-pyrrolidin-1-ylpropylamino)acetamide
CID 60697071
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 81491720
2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
CID 134049466
N-(1-methoxypropan-2-yl)-2-(3-methylpiperazin-1-yl)acetamide
CID 65448068
2-[4-(1-aminopentan-3-yl)piperazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 61488192

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide (CID 94784934) is N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide is COC[C@H](C)NC(=O)CN1CCCC1.
What is the InChIKey of N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide?
The InChIKey is KMBFBOCVAJXMPZ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(8-14-2)11-10(13)7-12-5-3-4-6-12/h9H,3-8H2,1-2H3,(H,11,13)/t9-/m0/s1.
What are the key properties of N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide?
N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 94784934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).