N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide

C13H26N2O2 — CID 103161433

IUPACN-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)NC(CC)CCN)C1
InChIInChI=1S/C13H26N2O2/c1-3-11(5-6-14)15-13(16)9-10-7-12(8-10)17-4-2/h10-12H,3-9,14H2,1-2H3,(H,15,16)
InChIKeyDVQOMFBKSDVCRR-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.44
Rot. Bonds8

About N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide

N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide (PubChem CID 103161433) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide
PubChem CID103161433
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)NC(CC)CCN)C1
InChIInChI=1S/C13H26N2O2/c1-3-11(5-6-14)15-13(16)9-10-7-12(8-10)17-4-2/h10-12H,3-9,14H2,1-2H3,(H,15,16)
InChIKeyDVQOMFBKSDVCRR-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide?
The IUPAC name of N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide (CID 103161433) is N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide.
What is the SMILES notation for N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide?
The canonical SMILES for N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide is CCOC1CC(CC(=O)NC(CC)CCN)C1.
What is the InChIKey of N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide?
The InChIKey is DVQOMFBKSDVCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-11(5-6-14)15-13(16)9-10-7-12(8-10)17-4-2/h10-12H,3-9,14H2,1-2H3,(H,15,16).
What are the key properties of N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide?
N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide has a molecular weight of 242.36 g/mol, XLogP of 1.44, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopentan-3-yl)-2-(3-ethoxycyclobutyl)acetamide is sourced from PubChem (CID 103161433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).