(4-amino-3-pyridinyl)-piperidin-4-ylmethanone

C11H15N3O — CID 116547555

IUPAC(4-amino-3-pyridinyl)-piperidin-4-ylmethanone
SMILESNc1ccncc1C(=O)C1CCNCC1
InChIInChI=1S/C11H15N3O/c12-10-3-6-14-7-9(10)11(15)8-1-4-13-5-2-8/h3,6-8,13H,1-2,4-5H2,(H2,12,14)
InChIKeySSKJTWHTKPRUKT-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.85
Rot. Bonds2

About (4-amino-3-pyridinyl)-piperidin-4-ylmethanone

(4-amino-3-pyridinyl)-piperidin-4-ylmethanone (PubChem CID 116547555) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (4-amino-3-pyridinyl)-piperidin-4-ylmethanone.

Molecular Properties

Compound Name(4-amino-3-pyridinyl)-piperidin-4-ylmethanone
PubChem CID116547555
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(4-amino-3-pyridinyl)-piperidin-4-ylmethanone
SMILESNc1ccncc1C(=O)C1CCNCC1
InChIInChI=1S/C11H15N3O/c12-10-3-6-14-7-9(10)11(15)8-1-4-13-5-2-8/h3,6-8,13H,1-2,4-5H2,(H2,12,14)
InChIKeySSKJTWHTKPRUKT-UHFFFAOYSA-N
XLogP0.85
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-amino-3-pyridinyl)-2-piperidin-4-yloxyethanone
CID 116570980
2-(4-amino-3-pyridinyl)-1-pyrrolidin-3-ylethanone
CID 116568289
piperidin-4-yl(pyridin-3-yl)methanone;hydrochloride
CID 46736476
(2-amino-4-fluorophenyl)-piperidin-4-ylmethanone
CID 105479129
(4-aminooxolan-3-yl)-(4-amino-3-pyridinyl)methanone
CID 116587384
(4-amino-3-pyridinyl)-(4-phenylpiperidin-4-yl)methanone
CID 116561844
pyridin-4-yl(pyrrolidin-3-yl)methanone;dihydrochloride
CID 91623851
4-amino-N-cycloheptylpyridine-3-carboxamide
CID 81236590
1,3-oxazol-2-yl(piperidin-4-yl)methanone;hydrochloride
CID 68771759
pyrazin-2-yl(pyrrolidin-3-yl)methanone
CID 116568351
(4-amino-3-pyridinyl)-(3-methylpiperidin-3-yl)methanone
CID 116569322
(4-amino-3-pyridinyl)-(2-methylpiperidin-1-yl)methanone;hydrochloride
CID 120607916

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-pyridinyl)-piperidin-4-ylmethanone?
The IUPAC name of (4-amino-3-pyridinyl)-piperidin-4-ylmethanone (CID 116547555) is (4-amino-3-pyridinyl)-piperidin-4-ylmethanone.
What is the SMILES notation for (4-amino-3-pyridinyl)-piperidin-4-ylmethanone?
The canonical SMILES for (4-amino-3-pyridinyl)-piperidin-4-ylmethanone is Nc1ccncc1C(=O)C1CCNCC1.
What is the InChIKey of (4-amino-3-pyridinyl)-piperidin-4-ylmethanone?
The InChIKey is SSKJTWHTKPRUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-10-3-6-14-7-9(10)11(15)8-1-4-13-5-2-8/h3,6-8,13H,1-2,4-5H2,(H2,12,14).
What are the key properties of (4-amino-3-pyridinyl)-piperidin-4-ylmethanone?
(4-amino-3-pyridinyl)-piperidin-4-ylmethanone has a molecular weight of 205.26 g/mol, XLogP of 0.85, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-pyridinyl)-piperidin-4-ylmethanone is sourced from PubChem (CID 116547555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).