(2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone

C14H21N3O — CID 62205465

IUPAC(2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone
SMILESCCCC1CCN(C(=O)c2ccnc(N)c2)CC1
InChIInChI=1S/C14H21N3O/c1-2-3-11-5-8-17(9-6-11)14(18)12-4-7-16-13(15)10-12/h4,7,10-11H,2-3,5-6,8-9H2,1H3,(H2,15,16)
InChIKeySBYHOSSANKJNMS-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.32
Rot. Bonds3

About (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone

(2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone (PubChem CID 62205465) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone
PubChem CID62205465
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name(2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone
SMILESCCCC1CCN(C(=O)c2ccnc(N)c2)CC1
InChIInChI=1S/C14H21N3O/c1-2-3-11-5-8-17(9-6-11)14(18)12-4-7-16-13(15)10-12/h4,7,10-11H,2-3,5-6,8-9H2,1H3,(H2,15,16)
InChIKeySBYHOSSANKJNMS-UHFFFAOYSA-N
XLogP2.32
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-amino-4-pyridinyl)-(4-propylpiperidin-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

Related Compounds

(2-amino-4-pyridinyl)-(4-methylpiperidin-1-yl)methanone
CID 62155864
(2-amino-4-pyridinyl)-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 106837602
2-amino-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 55042146
(2-amino-4-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 55158605
(3,5-dibromophenyl)-(4-propylpiperidin-1-yl)methanone
CID 107980414
4-(4-propylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62206687
(2-amino-4-pyridinyl)-(4-ethyl-4-propylpiperidin-1-yl)methanone
CID 123428768
(2-amino-4-pyridinyl)-(4-butan-2-ylpiperazin-1-yl)methanone
CID 62776991
1-[4-(2-aminopyridine-4-carbonyl)piperazin-1-yl]-2-hydroxyethanone
CID 167885756
(2-amino-4-pyridinyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107228705
(4-hydrazinylphenyl)-(4-propylpiperidin-1-yl)methanone
CID 62243172
[4-(propylamino)phenyl]-(4-propylpiperidin-1-yl)methanone
CID 62205102

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone?
The IUPAC name of (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone (CID 62205465) is (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone?
The canonical SMILES for (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone is CCCC1CCN(C(=O)c2ccnc(N)c2)CC1.
What is the InChIKey of (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone?
The InChIKey is SBYHOSSANKJNMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-2-3-11-5-8-17(9-6-11)14(18)12-4-7-16-13(15)10-12/h4,7,10-11H,2-3,5-6,8-9H2,1H3,(H2,15,16).
What are the key properties of (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone?
(2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone has a molecular weight of 247.34 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-pyridinyl)-(4-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 62205465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).