1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone

C10H20N2O2 — CID 174831695

IUPAC1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone
SMILESCC(=O)C1CCCN1NC(C)(C)CO
InChIInChI=1S/C10H20N2O2/c1-8(14)9-5-4-6-12(9)11-10(2,3)7-13/h9,11,13H,4-7H2,1-3H3
InChIKeyKNHPNFCNAKVXOR-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.32
Rot. Bonds4

About 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone

1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone (PubChem CID 174831695) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone.

Molecular Properties

Compound Name1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone
PubChem CID174831695
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone
SMILESCC(=O)C1CCCN1NC(C)(C)CO
InChIInChI=1S/C10H20N2O2/c1-8(14)9-5-4-6-12(9)11-10(2,3)7-13/h9,11,13H,4-7H2,1-3H3
InChIKeyKNHPNFCNAKVXOR-UHFFFAOYSA-N
XLogP0.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(methylamino)piperidin-2-yl]ethanone
CID 91056798
N-(1-hydroxy-2-methylpropan-2-yl)-2-[(2S)-1-methylpyrrolidin-2-yl]acetamide
CID 166072076
2-acetyl-N-methylpyrrolidine-1-carboxamide;2,2-dimethylpropane;ethane
CID 145483080
N-(2,2-difluoro-3-hydroxypropyl)-1-(2,2-dimethylpropanoyl)pyrrolidine-2-carboxamide
CID 104862896
1-[(2S)-1-(4,4-dimethylpent-1-en-2-yl)pyrrolidin-2-yl]ethanone
CID 142882538
1-[1-(2-hydroxy-2-methylpropyl)piperidin-2-yl]ethanone
CID 63844987
1-[(2R)-1-propan-2-ylpyrrolidin-2-yl]ethanone
CID 59945997
1-(cyclopropanecarbonyl)-N-(1-hydroxy-2-methylpropan-2-yl)piperidine-3-carboxamide
CID 43500690
3-(1-acetylpiperidin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)propanamide
CID 110000587
2-[(2R)-2-acetylpyrrolidin-1-yl]-3-hydroxypropanoic acid
CID 59945902
1-(2-acetylpyrrolidin-1-yl)-2-aminoethanone;ethane
CID 166119423
1-(2-acetylpiperidin-1-yl)-2,2-dimethylpropan-1-one
CID 58171936

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone?
The IUPAC name of 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone (CID 174831695) is 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone.
What is the SMILES notation for 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone?
The canonical SMILES for 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone is CC(=O)C1CCCN1NC(C)(C)CO.
What is the InChIKey of 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone?
The InChIKey is KNHPNFCNAKVXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(14)9-5-4-6-12(9)11-10(2,3)7-13/h9,11,13H,4-7H2,1-3H3.
What are the key properties of 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone?
1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone has a molecular weight of 200.28 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(1-hydroxy-2-methylpropan-2-yl)amino]pyrrolidin-2-yl]ethanone is sourced from PubChem (CID 174831695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).