5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one

C15H25N3O — CID 57196290

IUPAC5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
SMILESCCCCc1c(CN2CCCCC2)c(N)c[nH]c1=O
InChIInChI=1S/C15H25N3O/c1-2-3-7-12-13(14(16)10-17-15(12)19)11-18-8-5-4-6-9-18/h10H,2-9,11,16H2,1H3,(H,17,19)
InChIKeyZRYKAZXKEAGNFS-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.29
Rot. Bonds5

About 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one

5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one (PubChem CID 57196290) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
PubChem CID57196290
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
SMILESCCCCc1c(CN2CCCCC2)c(N)c[nH]c1=O
InChIInChI=1S/C15H25N3O/c1-2-3-7-12-13(14(16)10-17-15(12)19)11-18-8-5-4-6-9-18/h10H,2-9,11,16H2,1H3,(H,17,19)
InChIKeyZRYKAZXKEAGNFS-UHFFFAOYSA-N
XLogP2.29
TPSA62.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one 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-[(1-tert-butylpiperidin-4-yl)methyl]-4-fluoro-1H-pyridin-2-one
CID 90038587
5-amino-3-but-2-enyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-pyridin-2-one
CID 56990861
3-(4-aminobutyl)-4-[(3-methylpiperidin-1-yl)methyl]-1H-pyridin-2-one
CID 57032547
3-(3-aminopropyl)-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
CID 57042994
3-(4-aminobutyl)-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
CID 57050952
5-amino-3-but-2-enyl-4-[(4-methylpiperidin-1-yl)methyl]-1H-pyridin-2-one
CID 57076169
5-amino-3-butyl-4-[(dimethylamino)methyl]-1H-pyridin-2-one
CID 57180576
3-(4-aminobutyl)-4-[(dimethylamino)methyl]-1H-pyridin-2-one
CID 57181300
5-amino-3-but-2-enyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
CID 57221762
5-amino-3-butyl-4-(pyrrolidin-1-ylmethyl)-1H-pyridin-2-one
CID 57228449
3-(4-aminobutyl)-4-[(4-methylpiperazin-1-yl)methyl]-1H-pyridin-2-one
CID 57245086
5-amino-3-butyl-4-(morpholin-4-ylmethyl)-1H-pyridin-2-one
CID 57310388

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
The IUPAC name of 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one (CID 57196290) is 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one.
What is the SMILES notation for 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
The canonical SMILES for 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one is CCCCc1c(CN2CCCCC2)c(N)c[nH]c1=O.
What is the InChIKey of 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
The InChIKey is ZRYKAZXKEAGNFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-3-7-12-13(14(16)10-17-15(12)19)11-18-8-5-4-6-9-18/h10H,2-9,11,16H2,1H3,(H,17,19).
What are the key properties of 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one has a molecular weight of 263.38 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-butyl-4-(piperidin-1-ylmethyl)-1H-pyridin-2-one is sourced from PubChem (CID 57196290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).