N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide

C14H29N3O — CID 24707221

IUPACN-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide
SMILESCCN(CC)CCCNC(=O)CC1CCNCC1
InChIInChI=1S/C14H29N3O/c1-3-17(4-2)11-5-8-16-14(18)12-13-6-9-15-10-7-13/h13,15H,3-12H2,1-2H3,(H,16,18)
InChIKeyDHBJLXAEQREKPQ-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.22
Rot. Bonds8

About N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide

N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide (PubChem CID 24707221) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide
PubChem CID24707221
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide
SMILESCCN(CC)CCCNC(=O)CC1CCNCC1
InChIInChI=1S/C14H29N3O/c1-3-17(4-2)11-5-8-16-14(18)12-13-6-9-15-10-7-13/h13,15H,3-12H2,1-2H3,(H,16,18)
InChIKeyDHBJLXAEQREKPQ-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide?
The IUPAC name of N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide (CID 24707221) is N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide?
The canonical SMILES for N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide is CCN(CC)CCCNC(=O)CC1CCNCC1.
What is the InChIKey of N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide?
The InChIKey is DHBJLXAEQREKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-3-17(4-2)11-5-8-16-14(18)12-13-6-9-15-10-7-13/h13,15H,3-12H2,1-2H3,(H,16,18).
What are the key properties of N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide?
N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide has a molecular weight of 255.41 g/mol, XLogP of 1.22, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide is sourced from PubChem (CID 24707221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).