2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one

C10H18N2O2 — CID 62942113

IUPAC2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one
SMILESCC(N)(C(=O)N1CCC(O)C1)C1CC1
InChIInChI=1S/C10H18N2O2/c1-10(11,7-2-3-7)9(14)12-5-4-8(13)6-12/h7-8,13H,2-6,11H2,1H3
InChIKeyQBXJJCUIZSVXSB-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.29
Rot. Bonds2

About 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one

2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one (PubChem CID 62942113) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one
PubChem CID62942113
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one
SMILESCC(N)(C(=O)N1CCC(O)C1)C1CC1
InChIInChI=1S/C10H18N2O2/c1-10(11,7-2-3-7)9(14)12-5-4-8(13)6-12/h7-8,13H,2-6,11H2,1H3
InChIKeyQBXJJCUIZSVXSB-UHFFFAOYSA-N
XLogP-0.29
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(3-hydroxypiperidin-1-yl)-2-methylpropan-1-one
CID 61264597
2-amino-2-cyclopropyl-1-(4-propylpiperidin-1-yl)propan-1-one
CID 55050370
3-(3-hydroxypyrrolidin-1-yl)-2,2-dimethyl-3-oxopropanenitrile
CID 62943802
3-amino-1-(3-hydroxypyrrolidin-1-yl)-3-methylbutan-1-one
CID 64679140
3-[(3R)-3-hydroxypyrrolidin-1-yl]-2,2-dimethyl-3-oxopropanenitrile
CID 103719235
2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one
CID 103821153
2-[1-(2-amino-2-cyclopropylpropanoyl)piperidin-4-yl]oxyacetic acid
CID 63877468
methyl 4-(2-amino-2-cyclopropylpropanoyl)piperazine-1-carboxylate
CID 54916371
2-amino-2-cyclopropyl-1-(4-hydroxy-4-methylpiperidin-1-yl)propan-1-one
CID 81103870
1-[(3S)-3-hydroxypyrrolidin-1-yl]-2,3,3-trimethylbutan-1-one
CID 131007907
2-amino-2-cyclopropyl-1-[4-(3-methylbutyl)piperazin-1-yl]propan-1-one
CID 54873596
2-(aminomethyl)-2-ethyl-1-(3-hydroxypyrrolidin-1-yl)butan-1-one
CID 62942263

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one?
The IUPAC name of 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one (CID 62942113) is 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one.
What is the SMILES notation for 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one?
The canonical SMILES for 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one is CC(N)(C(=O)N1CCC(O)C1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one?
The InChIKey is QBXJJCUIZSVXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-10(11,7-2-3-7)9(14)12-5-4-8(13)6-12/h7-8,13H,2-6,11H2,1H3.
What are the key properties of 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one?
2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one has a molecular weight of 198.27 g/mol, XLogP of -0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-1-(3-hydroxypyrrolidin-1-yl)propan-1-one is sourced from PubChem (CID 62942113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).