3-amino-N-hexan-3-yloxolane-3-carboxamide

C11H22N2O2 — CID 64891018

IUPAC3-amino-N-hexan-3-yloxolane-3-carboxamide
SMILESCCCC(CC)NC(=O)C1(N)CCOC1
InChIInChI=1S/C11H22N2O2/c1-3-5-9(4-2)13-10(14)11(12)6-7-15-8-11/h9H,3-8,12H2,1-2H3,(H,13,14)
InChIKeyHDMPEXGCAHBYIH-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.80
Rot. Bonds5

About 3-amino-N-hexan-3-yloxolane-3-carboxamide

3-amino-N-hexan-3-yloxolane-3-carboxamide (PubChem CID 64891018) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-amino-N-hexan-3-yloxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-hexan-3-yloxolane-3-carboxamide
PubChem CID64891018
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-amino-N-hexan-3-yloxolane-3-carboxamide
SMILESCCCC(CC)NC(=O)C1(N)CCOC1
InChIInChI=1S/C11H22N2O2/c1-3-5-9(4-2)13-10(14)11(12)6-7-15-8-11/h9H,3-8,12H2,1-2H3,(H,13,14)
InChIKeyHDMPEXGCAHBYIH-UHFFFAOYSA-N
XLogP0.80
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-hexan-3-yloxolane-3-carboxamide?
The IUPAC name of 3-amino-N-hexan-3-yloxolane-3-carboxamide (CID 64891018) is 3-amino-N-hexan-3-yloxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-hexan-3-yloxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-hexan-3-yloxolane-3-carboxamide is CCCC(CC)NC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-hexan-3-yloxolane-3-carboxamide?
The InChIKey is HDMPEXGCAHBYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-5-9(4-2)13-10(14)11(12)6-7-15-8-11/h9H,3-8,12H2,1-2H3,(H,13,14).
What are the key properties of 3-amino-N-hexan-3-yloxolane-3-carboxamide?
3-amino-N-hexan-3-yloxolane-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-hexan-3-yloxolane-3-carboxamide is sourced from PubChem (CID 64891018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).