N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide

C14H29N3O3 — CID 155751772

IUPACN-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide
SMILESCCC(=O)NCCOCCOCCN1CCC(N)CC1
InChIInChI=1S/C14H29N3O3/c1-2-14(18)16-5-9-19-11-12-20-10-8-17-6-3-13(15)4-7-17/h13H,2-12,15H2,1H3,(H,16,18)
InChIKeyFMRAQFZCGXGDAU-UHFFFAOYSA-N
MW287.40 g/mol
LogP-0.03
Rot. Bonds10

About N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide

N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide (PubChem CID 155751772) has the molecular formula C14H29N3O3 and a molecular weight of 287.40 g/mol. Its IUPAC name is N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide
PubChem CID155751772
Molecular FormulaC14H29N3O3
Molecular Weight287.40 g/mol
Exact Mass287.22
IUPAC NameN-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide
SMILESCCC(=O)NCCOCCOCCN1CCC(N)CC1
InChIInChI=1S/C14H29N3O3/c1-2-14(18)16-5-9-19-11-12-20-10-8-17-6-3-13(15)4-7-17/h13H,2-12,15H2,1H3,(H,16,18)
InChIKeyFMRAQFZCGXGDAU-UHFFFAOYSA-N
XLogP-0.03
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.40
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-Acetyl-N-(2-methoxyethyl)piperidin-4-amine
CID 2761031
N-{1-[(2-Methoxy-ethylcarbamoyl)-methyl]-piperidin-4-yl}-2,2-dimethyl-propionamide
CID 3221021
N-[1-(2-methoxyethyl)piperidin-4-yl]-2-methylpropanamide
CID 53523431
1-(4-Aminopiperidin-1-yl)-2-methoxyethan-1-one
CID 16777912
1-(4-Aminopiperidin-1-yl)-2-methoxyethan-1-one hydrochloride
CID 42937265
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]piperidin-4-amine
CID 44592824
2-Methoxy-N-(piperidin-4-yl)acetamide
CID 16782129
N-[(4S)-3,3-difluoro-1-(2-methoxyethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 175623541
N-(3-morpholin-4-ylpropyl)acetamide
CID 299677
N-[1-(2-methoxyethyl)piperidin-4-yl]propanamide
CID 71784690
3-N-(1-N-mPEG3-piperidin-4-yl) lamotrigine
CID 113426782
N-(4-morpholin-4-ylbutyl)acetamide
CID 10512242

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide?
The IUPAC name of N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide (CID 155751772) is N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide.
What is the SMILES notation for N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide?
The canonical SMILES for N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide is CCC(=O)NCCOCCOCCN1CCC(N)CC1.
What is the InChIKey of N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide?
The InChIKey is FMRAQFZCGXGDAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O3/c1-2-14(18)16-5-9-19-11-12-20-10-8-17-6-3-13(15)4-7-17/h13H,2-12,15H2,1H3,(H,16,18).
What are the key properties of N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide?
N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide has a molecular weight of 287.40 g/mol, XLogP of -0.03, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(4-aminopiperidin-1-yl)ethoxy]ethoxy]ethyl]propanamide is sourced from PubChem (CID 155751772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).