5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide

C13H27N3O2 — CID 114281721

IUPAC5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide
SMILESNCCCOC1CCN(CCCCC(N)=O)CC1
InChIInChI=1S/C13H27N3O2/c14-7-3-11-18-12-5-9-16(10-6-12)8-2-1-4-13(15)17/h12H,1-11,14H2,(H2,15,17)
InChIKeyPCIAUQYVQDTBBN-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.47
Rot. Bonds9

About 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide

5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide (PubChem CID 114281721) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide.

Molecular Properties

Compound Name5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide
PubChem CID114281721
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC Name5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide
SMILESNCCCOC1CCN(CCCCC(N)=O)CC1
InChIInChI=1S/C13H27N3O2/c14-7-3-11-18-12-5-9-16(10-6-12)8-2-1-4-13(15)17/h12H,1-11,14H2,(H2,15,17)
InChIKeyPCIAUQYVQDTBBN-UHFFFAOYSA-N
XLogP0.47
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide 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

1-[4-(3-Aminopropoxy)piperidin-1-yl]-4,4,4-trifluorobutan-1-one
CID 79732825
3-(Piperidin-4-yloxy)propanamide
CID 43346268
5-Morpholinopentanamide
CID 54400757
5-Amino-1-morpholin-4-ylpentan-1-one
CID 54404632
4-(4-Methoxypiperidin-1-yl)butanamide
CID 69155884
1-[4-(3-Aminopropoxy)piperidin-1-yl]ethanone
CID 79731900
1-[4-(3-Aminopropoxy)piperidin-1-yl]propan-1-one
CID 79732418
N-[2-(4-ethoxypiperidin-1-yl)ethyl]butanamide
CID 143791008
6-Amino-1-(4-methoxypiperidin-1-yl)hexan-1-one
CID 43373178
4-Amino-1-(4-methoxypiperidin-1-yl)butan-1-one
CID 43373179
4-Amino-1-[4-(2-ethoxyethoxy)piperidin-1-yl]butan-1-one
CID 54872251
N-(3-piperidin-4-yloxypropyl)pentanamide
CID 55252330

Frequently Asked Questions

What is the IUPAC name of 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide?
The IUPAC name of 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide (CID 114281721) is 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide.
What is the SMILES notation for 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide?
The canonical SMILES for 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide is NCCCOC1CCN(CCCCC(N)=O)CC1.
What is the InChIKey of 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide?
The InChIKey is PCIAUQYVQDTBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c14-7-3-11-18-12-5-9-16(10-6-12)8-2-1-4-13(15)17/h12H,1-11,14H2,(H2,15,17).
What are the key properties of 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide?
5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide has a molecular weight of 257.38 g/mol, XLogP of 0.47, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(3-aminopropoxy)piperidin-1-yl]pentanamide is sourced from PubChem (CID 114281721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).