N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide

C13H26N2O2 — CID 106116037

IUPACN-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide
SMILESCCCC(CCN)CNC(=O)CC1CCCO1
InChIInChI=1S/C13H26N2O2/c1-2-4-11(6-7-14)10-15-13(16)9-12-5-3-8-17-12/h11-12H,2-10,14H2,1H3,(H,15,16)
InChIKeyYPIZIIJASPQRCZ-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.44
Rot. Bonds8

About N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide

N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide (PubChem CID 106116037) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide
PubChem CID106116037
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide
SMILESCCCC(CCN)CNC(=O)CC1CCCO1
InChIInChI=1S/C13H26N2O2/c1-2-4-11(6-7-14)10-15-13(16)9-12-5-3-8-17-12/h11-12H,2-10,14H2,1H3,(H,15,16)
InChIKeyYPIZIIJASPQRCZ-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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Related Compounds

N-[2-(2-bromoethyl)pentyl]-2-(oxolan-2-yl)acetamide
CID 106118076
4-[2-[[2-(oxolan-2-yl)acetyl]amino]ethyl]heptanoic acid
CID 65157479
N-[2-(2-chloroethyl)pentyl]-3-(oxan-2-yl)propanamide
CID 106117578
N-[2-(2-aminoethyl)pentyl]cyclopentanecarboxamide
CID 106116208
(2S)-2-hydroxy-3-[[2-(oxolan-2-yl)acetyl]amino]propanoic acid
CID 107833848
N-(3-amino-3-hydroxyimino-2-methylpropyl)-2-(oxolan-2-yl)acetamide
CID 77057841
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide
CID 95333344
N-(2-acetamidoethyl)-2-(oxolan-2-yl)acetamide
CID 110696614
2-(oxolan-2-yl)-N-prop-2-ynylacetamide
CID 60769102
N-[2-(2-aminoethyl)pentyl]azepane-1-carboxamide
CID 106116291
2-(oxan-2-yl)-N-pentylacetamide
CID 110415818

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide?
The IUPAC name of N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide (CID 106116037) is N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide is CCCC(CCN)CNC(=O)CC1CCCO1.
What is the InChIKey of N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide?
The InChIKey is YPIZIIJASPQRCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-2-4-11(6-7-14)10-15-13(16)9-12-5-3-8-17-12/h11-12H,2-10,14H2,1H3,(H,15,16).
What are the key properties of N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide?
N-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)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-[2-(2-aminoethyl)pentyl]-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 106116037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).