(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone

C11H15N3O — CID 62151940

IUPAC(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone
SMILESCC1CCCN1C(=O)c1ccc(N)nc1
InChIInChI=1S/C11H15N3O/c1-8-3-2-6-14(8)11(15)9-4-5-10(12)13-7-9/h4-5,7-8H,2-3,6H2,1H3,(H2,12,13)
InChIKeyMERJMYXCQNRMLZ-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.29
Rot. Bonds1

About (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone

(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone (PubChem CID 62151940) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone
PubChem CID62151940
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone
SMILESCC1CCCN1C(=O)c1ccc(N)nc1
InChIInChI=1S/C11H15N3O/c1-8-3-2-6-14(8)11(15)9-4-5-10(12)13-7-9/h4-5,7-8H,2-3,6H2,1H3,(H2,12,13)
InChIKeyMERJMYXCQNRMLZ-UHFFFAOYSA-N
XLogP1.29
TPSA59.22 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 ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6-methyl-3-pyridinyl)-[(2R)-2-methylpyrrolidin-1-yl]methanone
CID 10058742
[6-[(2S)-2-methylpiperidine-1-carbonyl]-3-pyridinyl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 1222984
(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone
CID 10038899
(4-aminophenyl)-[(2S)-2-methylpiperidin-1-yl]methanone
CID 713107
N'-hydroxy-6-(2-methylpyrrolidine-1-carbonyl)pyridine-3-carboximidamide
CID 77005324
(5-amino-3-pyridinyl)-(2-methylpiperidin-1-yl)methanone
CID 102568289
[(2S)-2-methylpyrrolidin-1-yl]-(4-phenylphenyl)methanone
CID 174598087
(6-amino-3-pyridinyl)-(2-ethyl-5-methylpyrrolidin-1-yl)methanone
CID 83221125
(6-amino-3-pyridinyl)-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]methanone
CID 81212789
[4-(methylamino)phenyl]-(2-methylpiperidin-1-yl)methanone
CID 62170939
(5-amino-2-pyridinyl)-(2-methylpiperidin-1-yl)methanone
CID 81319885
(2-amino-1,3-benzothiazol-6-yl)-(2-methylpyrrolidin-1-yl)methanone
CID 65349298

Frequently Asked Questions

What is the IUPAC name of (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone?
The IUPAC name of (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone (CID 62151940) is (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone is CC1CCCN1C(=O)c1ccc(N)nc1.
What is the InChIKey of (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone?
The InChIKey is MERJMYXCQNRMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-3-2-6-14(8)11(15)9-4-5-10(12)13-7-9/h4-5,7-8H,2-3,6H2,1H3,(H2,12,13).
What are the key properties of (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone?
(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone has a molecular weight of 205.26 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 62151940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).