(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone

C12H17N3O — CID 62239764

IUPAC(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2cccc(N)n2)CC1
InChIInChI=1S/C12H17N3O/c1-9-5-7-15(8-6-9)12(16)10-3-2-4-11(13)14-10/h2-4,9H,5-8H2,1H3,(H2,13,14)
InChIKeyPSMDMMNHKYLMPZ-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.54
Rot. Bonds1

About (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone

(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 62239764) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone
PubChem CID62239764
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)c2cccc(N)n2)CC1
InChIInChI=1S/C12H17N3O/c1-9-5-7-15(8-6-9)12(16)10-3-2-4-11(13)14-10/h2-4,9H,5-8H2,1H3,(H2,13,14)
InChIKeyPSMDMMNHKYLMPZ-UHFFFAOYSA-N
XLogP1.54
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone (CID 62239764) is (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)c2cccc(N)n2)CC1.
What is the InChIKey of (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is PSMDMMNHKYLMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-9-5-7-15(8-6-9)12(16)10-3-2-4-11(13)14-10/h2-4,9H,5-8H2,1H3,(H2,13,14).
What are the key properties of (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone?
(6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 219.29 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-2-pyridinyl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 62239764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).