[6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone

C11H15N3O — CID 82506917

IUPAC[6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESNCc1cccc(C(=O)N2CCCC2)n1
InChIInChI=1S/C11H15N3O/c12-8-9-4-3-5-10(13-9)11(15)14-6-1-2-7-14/h3-5H,1-2,6-8,12H2
InChIKeyVIZPMIYGITXKRU-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.78
Rot. Bonds2

About [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone

[6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 82506917) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID82506917
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name[6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESNCc1cccc(C(=O)N2CCCC2)n1
InChIInChI=1S/C11H15N3O/c12-8-9-4-3-5-10(13-9)11(15)14-6-1-2-7-14/h3-5H,1-2,6-8,12H2
InChIKeyVIZPMIYGITXKRU-UHFFFAOYSA-N
XLogP0.78
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 134117115
azepan-1-yl-[6-[(2,6-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]methanone
CID 11990096
6-(piperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 43558285
[6-[(3-methylazetidin-1-yl)methyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 177347694
ethyl 4-[6-(azepane-1-carbonyl)pyridine-2-carbonyl]piperazine-1-carboxylate
CID 109098906
azocan-1-yl-[6-[(2,6-dimethylphenyl)sulfonylmethyl]-2-pyridinyl]methanone
CID 58210677
azepan-1-yl-[6-[(2,6-dimethylphenyl)sulfonylmethyl]-2-pyridinyl]methanone
CID 58211013
azepan-1-yl-[6-(azepan-1-yl)-2-pyridinyl]methanone
CID 84573821
azepan-1-yl-[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]methanone
CID 58210853
ethane;[6-[(3-methylpyrrolidin-1-yl)methyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 177348708
azepan-1-yl-[6-[(2,4,6-trichlorophenoxy)methyl]-2-pyridinyl]methanone
CID 58211391
[6-(2-chlorophenyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 58211047

Frequently Asked Questions

What is the IUPAC name of [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone (CID 82506917) is [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone is NCc1cccc(C(=O)N2CCCC2)n1.
What is the InChIKey of [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is VIZPMIYGITXKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-8-9-4-3-5-10(13-9)11(15)14-6-1-2-7-14/h3-5H,1-2,6-8,12H2.
What are the key properties of [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
[6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 205.26 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(aminomethyl)-2-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 82506917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).