(4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone

C13H19N3O — CID 81457541

IUPAC(4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone
SMILESCCC1CN(C(=O)c2ccccn2)CCC1N
InChIInChI=1S/C13H19N3O/c1-2-10-9-16(8-6-11(10)14)13(17)12-5-3-4-7-15-12/h3-5,7,10-11H,2,6,8-9,14H2,1H3
InChIKeyXGBDGVNDHVBZFK-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.28
Rot. Bonds2

About (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone

(4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone (PubChem CID 81457541) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone
PubChem CID81457541
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name(4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone
SMILESCCC1CN(C(=O)c2ccccn2)CCC1N
InChIInChI=1S/C13H19N3O/c1-2-10-9-16(8-6-11(10)14)13(17)12-5-3-4-7-15-12/h3-5,7,10-11H,2,6,8-9,14H2,1H3
InChIKeyXGBDGVNDHVBZFK-UHFFFAOYSA-N
XLogP1.28
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-amino-3-ethylpiperidin-1-yl)-pyridin-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

(3-aminopyrrolidin-1-yl)-pyridin-2-ylmethanone
CID 59657975
[(3R)-3-aminopyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 53256401
(4-amino-3-ethylpiperidin-1-yl)-(6-methyl-2-pyridinyl)methanone
CID 81458540
[3-(aminomethyl)pyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 62063206
(3-aminopiperidin-1-yl)-pyridin-2-ylmethanone
CID 61295902
(4-amino-3-ethylpiperidin-1-yl)-(2-methoxy-3-pyridinyl)methanone
CID 81458525
[4-(aminomethyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 21221047
(4-amino-3-ethylpiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 81457893
(4-amino-3-ethylpiperidin-1-yl)-(1H-pyrrol-2-yl)methanone
CID 81457630
(4-amino-3-ethylpiperidin-1-yl)-(3-hydroxy-4-pyridinyl)methanone
CID 81458088
[(3S,4R)-4-methoxy-3-[(4-methoxyphenyl)methyl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 97422477
(4-amino-3-ethylpiperidin-1-yl)-(1H-indazol-3-yl)methanone
CID 81457192

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone?
The IUPAC name of (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone (CID 81457541) is (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone.
What is the SMILES notation for (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone?
The canonical SMILES for (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone is CCC1CN(C(=O)c2ccccn2)CCC1N.
What is the InChIKey of (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone?
The InChIKey is XGBDGVNDHVBZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-10-9-16(8-6-11(10)14)13(17)12-5-3-4-7-15-12/h3-5,7,10-11H,2,6,8-9,14H2,1H3.
What are the key properties of (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone?
(4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone has a molecular weight of 233.31 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-ethylpiperidin-1-yl)-pyridin-2-ylmethanone is sourced from PubChem (CID 81457541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).