(6-methyl-3-pyridinyl)-piperazin-1-ylmethanone

C11H15N3O — CID 16787061

IUPAC(6-methyl-3-pyridinyl)-piperazin-1-ylmethanone
SMILESCc1ccc(C(=O)N2CCNCC2)cn1
InChIInChI=1S/C11H15N3O/c1-9-2-3-10(8-13-9)11(15)14-6-4-12-5-7-14/h2-3,8,12H,4-7H2,1H3
InChIKeyJBUHWPDRAZUMJX-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.44
Rot. Bonds1

About (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone

(6-methyl-3-pyridinyl)-piperazin-1-ylmethanone (PubChem CID 16787061) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone.

Molecular Properties

Compound Name(6-methyl-3-pyridinyl)-piperazin-1-ylmethanone
PubChem CID16787061
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(6-methyl-3-pyridinyl)-piperazin-1-ylmethanone
SMILESCc1ccc(C(=O)N2CCNCC2)cn1
InChIInChI=1S/C11H15N3O/c1-9-2-3-10(8-13-9)11(15)14-6-4-12-5-7-14/h2-3,8,12H,4-7H2,1H3
InChIKeyJBUHWPDRAZUMJX-UHFFFAOYSA-N
XLogP0.44
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methylpyrimidin-5-yl)-piperazin-1-ylmethanone
CID 82507134
[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]-(4-propan-2-ylphenyl)methanone
CID 39991441
1-(6-methylpyridine-3-carbonyl)piperidine-4-carboxylic acid
CID 16790190
[6-(2,2-dimethylpropyl)-3-pyridinyl]-piperazin-1-ylmethanone
CID 58674992
4-(6-methylpyridine-3-carbonyl)-1,4-diazepan-2-one
CID 62896067
(6-methyl-3-pyridinyl)-(3-methylpyrrolidin-1-yl)methanone
CID 144534976
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(6-methyl-3-pyridinyl)methanone
CID 10445416
(6-methyl-3-pyridinyl)-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119999664
(3-aminoazetidin-1-yl)-(6-methyl-3-pyridinyl)methanone
CID 63753826
1-[4-(piperazine-1-carbonyl)phenyl]ethanone
CID 82510195
(4-methylpiperazin-1-yl)-(6-methyl-3-pyridinyl)methanone;2,2,2-trifluoroacetic acid
CID 71396472
[4-(2-methylphenyl)piperazin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 18147919

Frequently Asked Questions

What is the IUPAC name of (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone?
The IUPAC name of (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone (CID 16787061) is (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone.
What is the SMILES notation for (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone?
The canonical SMILES for (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone is Cc1ccc(C(=O)N2CCNCC2)cn1.
What is the InChIKey of (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone?
The InChIKey is JBUHWPDRAZUMJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-9-2-3-10(8-13-9)11(15)14-6-4-12-5-7-14/h2-3,8,12H,4-7H2,1H3.
What are the key properties of (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone?
(6-methyl-3-pyridinyl)-piperazin-1-ylmethanone has a molecular weight of 205.26 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-3-pyridinyl)-piperazin-1-ylmethanone is sourced from PubChem (CID 16787061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).