[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone

C11H18N2O — CID 130877423

IUPAC[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone
SMILESCC1CCCN1C(=O)C1[C@H]2CNC[C@@H]12
InChIInChI=1S/C11H18N2O/c1-7-3-2-4-13(7)11(14)10-8-5-12-6-9(8)10/h7-10,12H,2-6H2,1H3/t7?,8-,9+,10?
InChIKeyAXJRPROWEFMMHM-XWJSGITJSA-N
MW194.28 g/mol
LogP0.46
Rot. Bonds1

About [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone

[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone (PubChem CID 130877423) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone
PubChem CID130877423
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone
SMILESCC1CCCN1C(=O)C1[C@H]2CNC[C@@H]12
InChIInChI=1S/C11H18N2O/c1-7-3-2-4-13(7)11(14)10-8-5-12-6-9(8)10/h7-10,12H,2-6H2,1H3/t7?,8-,9+,10?
InChIKeyAXJRPROWEFMMHM-XWJSGITJSA-N
XLogP0.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone with MolForge

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Related Compounds

[(2S)-2-methylpyrrolidin-1-yl]-[(3S)-pyrrolidin-3-yl]methanone
CID 59401908
7-bicyclo[4.1.0]heptanyl-[(2S)-2-methylpiperazin-1-yl]methanone
CID 82704835
6-bicyclo[3.1.0]hexanyl-(2-methylpiperazin-1-yl)methanone;hydrochloride
CID 119470839
(2-methylcyclopropyl)-(2-methylpyrrolidin-1-yl)methanone
CID 123276609
(2-methylpiperidin-1-yl)-[(3R)-piperidin-3-yl]methanone
CID 81123466
7-bicyclo[4.1.0]heptanyl-(2,6-dimethylpiperazin-1-yl)methanone
CID 81479273
(2-methylpyrrolidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 90464822
(2-methylpiperidin-1-yl)-(1-piperidin-4-ylpyrrolidin-2-yl)methanone
CID 61020224
2-(2-methylpiperidine-1-carbonyl)cyclobutane-1-carboxylic acid
CID 120974339
7-bicyclo[4.1.0]heptanyl-(3-methylmorpholin-4-yl)methanone
CID 71925557
(2-methylpyrrolidin-1-yl)-(1-methylsulfonylpiperidin-4-yl)methanone
CID 110728182
[(2R)-azepan-2-yl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 124507947

Frequently Asked Questions

What is the IUPAC name of [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone?
The IUPAC name of [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone (CID 130877423) is [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone is CC1CCCN1C(=O)C1[C@H]2CNC[C@@H]12.
What is the InChIKey of [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone?
The InChIKey is AXJRPROWEFMMHM-XWJSGITJSA-N. The full InChI is InChI=1S/C11H18N2O/c1-7-3-2-4-13(7)11(14)10-8-5-12-6-9(8)10/h7-10,12H,2-6H2,1H3/t7?,8-,9+,10?.
What are the key properties of [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone?
[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone has a molecular weight of 194.28 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-(2-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 130877423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).