(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone

C12H19NO2 — CID 165447366

IUPAC(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone
SMILESCC1(C(=O)N2CCC(O)(C3CC3)C2)CC1
InChIInChI=1S/C12H19NO2/c1-11(4-5-11)10(14)13-7-6-12(15,8-13)9-2-3-9/h9,15H,2-8H2,1H3
InChIKeyVWDCCTJWCWUFSB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.16
Rot. Bonds2

About (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone

(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone (PubChem CID 165447366) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone.

Molecular Properties

Compound Name(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone
PubChem CID165447366
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone
SMILESCC1(C(=O)N2CCC(O)(C3CC3)C2)CC1
InChIInChI=1S/C12H19NO2/c1-11(4-5-11)10(14)13-7-6-12(15,8-13)9-2-3-9/h9,15H,2-8H2,1H3
InChIKeyVWDCCTJWCWUFSB-UHFFFAOYSA-N
XLogP1.16
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)methanone
CID 165447364
(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 66475400
[(3S)-3-hydroxypyrrolidin-1-yl]-(1-methylcyclopropyl)methanone
CID 130162770
(4-aminopiperidin-1-yl)-(1-methylcyclopropyl)methanone;hydrochloride
CID 166001469
3-hydroxy-1-(1-methylcyclopropanecarbonyl)piperidine-3-carboxamide
CID 136541656
(4-amino-3,3-dimethylpiperidin-1-yl)-(1-methylcyclopentyl)methanone
CID 120817727
3-cyclopropyl-3-hydroxy-N,N-dimethylazetidine-1-carboxamide
CID 79154860
1-methyl-3-(4-methylcyclohexyl)pyrrolidin-3-ol
CID 64749345
(4-chloro-3,3-dimethylpyrrolidin-1-yl)-(1-methylcyclopropyl)methanone
CID 130909233
(3-amino-3-ethylpiperidin-1-yl)-(1-methylcyclopropyl)methanone
CID 165465972
3,9-diazabicyclo[4.2.1]nonan-3-yl-(1-methylcyclopropyl)methanone;hydrochloride
CID 119635654
[4-(methylamino)piperidin-1-yl]-(1-methylcyclobutyl)methanone
CID 119561901

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone?
The IUPAC name of (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone (CID 165447366) is (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone.
What is the SMILES notation for (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone?
The canonical SMILES for (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone is CC1(C(=O)N2CCC(O)(C3CC3)C2)CC1.
What is the InChIKey of (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone?
The InChIKey is VWDCCTJWCWUFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-11(4-5-11)10(14)13-7-6-12(15,8-13)9-2-3-9/h9,15H,2-8H2,1H3.
What are the key properties of (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone?
(3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone has a molecular weight of 209.29 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyl-3-hydroxypyrrolidin-1-yl)-(1-methylcyclopropyl)methanone is sourced from PubChem (CID 165447366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).