2-amino-4-(2-propylpiperidin-1-yl)butanamide

C12H25N3O — CID 83062448

IUPAC2-amino-4-(2-propylpiperidin-1-yl)butanamide
SMILESCCCC1CCCCN1CCC(N)C(N)=O
InChIInChI=1S/C12H25N3O/c1-2-5-10-6-3-4-8-15(10)9-7-11(13)12(14)16/h10-11H,2-9,13H2,1H3,(H2,14,16)
InChIKeyQETGXXQWTOQKLH-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.84
Rot. Bonds6

About 2-amino-4-(2-propylpiperidin-1-yl)butanamide

2-amino-4-(2-propylpiperidin-1-yl)butanamide (PubChem CID 83062448) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-amino-4-(2-propylpiperidin-1-yl)butanamide.

Molecular Properties

Compound Name2-amino-4-(2-propylpiperidin-1-yl)butanamide
PubChem CID83062448
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name2-amino-4-(2-propylpiperidin-1-yl)butanamide
SMILESCCCC1CCCCN1CCC(N)C(N)=O
InChIInChI=1S/C12H25N3O/c1-2-5-10-6-3-4-8-15(10)9-7-11(13)12(14)16/h10-11H,2-9,13H2,1H3,(H2,14,16)
InChIKeyQETGXXQWTOQKLH-UHFFFAOYSA-N
XLogP0.84
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-4-(2-propylpiperidin-1-yl)butanamide 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-(propan-2-ylamino)-4-(2-propylpiperidin-1-yl)butanamide
CID 83062596
2-(cyclopropylamino)-4-(2-propylpiperidin-1-yl)butanamide
CID 83062215
5,5-dimethyl-1-(2-propylpiperidin-1-yl)hexan-3-amine
CID 113497212
ethyl 2-amino-4-(2-ethylpiperidin-1-yl)butanoate
CID 63027661
2-amino-4-(2-ethylpiperidin-1-yl)butanoic acid
CID 63028622
2-(cyclopropylamino)-4-(2-propylpiperidin-1-yl)butanoic acid
CID 83062373
1-pentyl-2-propylpiperidine
CID 54429991
2,2-dimethyl-4-(2-propylpiperidin-1-yl)butanethioamide
CID 83056160
2-ethoxy-4-(2-propylpiperidin-1-yl)butan-1-amine
CID 83052818
3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83052825
ethyl 6-(2-propylpiperidin-1-yl)hexanoate
CID 83055887
2-methyl-2-(propan-2-ylamino)-4-(2-propylpiperidin-1-yl)butanoic acid
CID 83061908

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2-propylpiperidin-1-yl)butanamide?
The IUPAC name of 2-amino-4-(2-propylpiperidin-1-yl)butanamide (CID 83062448) is 2-amino-4-(2-propylpiperidin-1-yl)butanamide.
What is the SMILES notation for 2-amino-4-(2-propylpiperidin-1-yl)butanamide?
The canonical SMILES for 2-amino-4-(2-propylpiperidin-1-yl)butanamide is CCCC1CCCCN1CCC(N)C(N)=O.
What is the InChIKey of 2-amino-4-(2-propylpiperidin-1-yl)butanamide?
The InChIKey is QETGXXQWTOQKLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-2-5-10-6-3-4-8-15(10)9-7-11(13)12(14)16/h10-11H,2-9,13H2,1H3,(H2,14,16).
What are the key properties of 2-amino-4-(2-propylpiperidin-1-yl)butanamide?
2-amino-4-(2-propylpiperidin-1-yl)butanamide has a molecular weight of 227.35 g/mol, XLogP of 0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2-propylpiperidin-1-yl)butanamide is sourced from PubChem (CID 83062448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).