(2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone

C11H14ClN3O — CID 116547814

IUPAC(2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone
SMILESNc1ncc(Cl)cc1C(=O)C1CCCCN1
InChIInChI=1S/C11H14ClN3O/c12-7-5-8(11(13)15-6-7)10(16)9-3-1-2-4-14-9/h5-6,9,14H,1-4H2,(H2,13,15)
InChIKeyZERFGXBHPQVAKB-UHFFFAOYSA-N
MW239.71 g/mol
LogP1.64
Rot. Bonds2

About (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone

(2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone (PubChem CID 116547814) has the molecular formula C11H14ClN3O and a molecular weight of 239.71 g/mol. Its IUPAC name is (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone.

Molecular Properties

Compound Name(2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone
PubChem CID116547814
Molecular FormulaC11H14ClN3O
Molecular Weight239.71 g/mol
Exact Mass239.08
IUPAC Name(2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone
SMILESNc1ncc(Cl)cc1C(=O)C1CCCCN1
InChIInChI=1S/C11H14ClN3O/c12-7-5-8(11(13)15-6-7)10(16)9-3-1-2-4-14-9/h5-6,9,14H,1-4H2,(H2,13,15)
InChIKeyZERFGXBHPQVAKB-UHFFFAOYSA-N
XLogP1.64
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone with MolForge

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

Launch Full Analysis

Related Compounds

(6-chloro-1H-indol-3-yl)-piperidin-2-ylmethanone
CID 64867873
(2-amino-5-chloro-3-pyridinyl)-(cyclohepten-1-yl)methanone
CID 103450525
(2-amino-5-chloro-3-pyridinyl)-(4-aminooxolan-3-yl)methanone
CID 116587504
5-chloro-3-[(2S)-pyrrolidin-2-yl]pyridin-2-amine
CID 55273654
(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-piperidin-2-ylmethanone
CID 64865742
(5-chloro-1H-indol-3-yl)-pyrrolidin-2-ylmethanone
CID 64866390
(4-methyl-3-pyridinyl)-piperidin-2-ylmethanone
CID 116547900
2-amino-5-chloro-N-[[(2S)-piperidin-2-yl]methyl]pyridine-3-sulfonamide
CID 124702622
(4-cyclopropyloxy-3-pyridinyl)-[(2R)-piperidin-2-yl]methanone
CID 178103263
(2S)-N-(5-chloro-2-pyridinyl)pyrrolidine-2-carboxamide
CID 24749623
1-(2-amino-5-chloro-3-pyridinyl)-2-(cyclopropylmethylamino)ethanone
CID 116557644
(2-amino-5-chloro-3-pyridinyl)-(4-methylpiperidin-4-yl)methanone
CID 116567605

Frequently Asked Questions

What is the IUPAC name of (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone?
The IUPAC name of (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone (CID 116547814) is (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone.
What is the SMILES notation for (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone?
The canonical SMILES for (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone is Nc1ncc(Cl)cc1C(=O)C1CCCCN1.
What is the InChIKey of (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone?
The InChIKey is ZERFGXBHPQVAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O/c12-7-5-8(11(13)15-6-7)10(16)9-3-1-2-4-14-9/h5-6,9,14H,1-4H2,(H2,13,15).
What are the key properties of (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone?
(2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone has a molecular weight of 239.71 g/mol, XLogP of 1.64, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-chloro-3-pyridinyl)-piperidin-2-ylmethanone is sourced from PubChem (CID 116547814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).