(1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone

C10H19N3O — CID 19704824

IUPAC(1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone
SMILESCN1CCCC1C(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O/c1-12-6-2-3-9(12)10(14)13-7-4-11-5-8-13/h9,11H,2-8H2,1H3
InChIKeyAMYCICQYTOATBX-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.49
Rot. Bonds1

About (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone

(1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone (PubChem CID 19704824) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone.

Molecular Properties

Compound Name(1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone
PubChem CID19704824
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name(1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone
SMILESCN1CCCC1C(=O)N1CCNCC1
InChIInChI=1S/C10H19N3O/c1-12-6-2-3-9(12)10(14)13-7-4-11-5-8-13/h9,11H,2-8H2,1H3
InChIKeyAMYCICQYTOATBX-UHFFFAOYSA-N
XLogP-0.49
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone?
The IUPAC name of (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone (CID 19704824) is (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone.
What is the SMILES notation for (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone?
The canonical SMILES for (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone is CN1CCCC1C(=O)N1CCNCC1.
What is the InChIKey of (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone?
The InChIKey is AMYCICQYTOATBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-12-6-2-3-9(12)10(14)13-7-4-11-5-8-13/h9,11H,2-8H2,1H3.
What are the key properties of (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone?
(1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone has a molecular weight of 197.28 g/mol, XLogP of -0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrrolidin-2-yl)-piperazin-1-ylmethanone is sourced from PubChem (CID 19704824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).