N,N'-bis(oxolan-2-ylmethyl)pentanediamide

C15H26N2O4 — CID 2930688

IUPACN,N'-bis(oxolan-2-ylmethyl)pentanediamide
SMILESO=C(CCCC(=O)NCC1CCCO1)NCC1CCCO1
InChIInChI=1S/C15H26N2O4/c18-14(16-10-12-4-2-8-20-12)6-1-7-15(19)17-11-13-5-3-9-21-13/h12-13H,1-11H2,(H,16,18)(H,17,19)
InChIKeyDVPYZMXIVHCJCH-UHFFFAOYSA-N
MW298.38 g/mol
LogP0.75
Rot. Bonds8

About N,N'-bis(oxolan-2-ylmethyl)pentanediamide

N,N'-bis(oxolan-2-ylmethyl)pentanediamide (PubChem CID 2930688) has the molecular formula C15H26N2O4 and a molecular weight of 298.38 g/mol. Its IUPAC name is N,N'-bis(oxolan-2-ylmethyl)pentanediamide.

Molecular Properties

Compound NameN,N'-bis(oxolan-2-ylmethyl)pentanediamide
PubChem CID2930688
Molecular FormulaC15H26N2O4
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC NameN,N'-bis(oxolan-2-ylmethyl)pentanediamide
SMILESO=C(CCCC(=O)NCC1CCCO1)NCC1CCCO1
InChIInChI=1S/C15H26N2O4/c18-14(16-10-12-4-2-8-20-12)6-1-7-15(19)17-11-13-5-3-9-21-13/h12-13H,1-11H2,(H,16,18)(H,17,19)
InChIKeyDVPYZMXIVHCJCH-UHFFFAOYSA-N
XLogP0.75
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(oxolan-2-ylmethyl)pentanediamide?
The IUPAC name of N,N'-bis(oxolan-2-ylmethyl)pentanediamide (CID 2930688) is N,N'-bis(oxolan-2-ylmethyl)pentanediamide.
What is the SMILES notation for N,N'-bis(oxolan-2-ylmethyl)pentanediamide?
The canonical SMILES for N,N'-bis(oxolan-2-ylmethyl)pentanediamide is O=C(CCCC(=O)NCC1CCCO1)NCC1CCCO1.
What is the InChIKey of N,N'-bis(oxolan-2-ylmethyl)pentanediamide?
The InChIKey is DVPYZMXIVHCJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O4/c18-14(16-10-12-4-2-8-20-12)6-1-7-15(19)17-11-13-5-3-9-21-13/h12-13H,1-11H2,(H,16,18)(H,17,19).
What are the key properties of N,N'-bis(oxolan-2-ylmethyl)pentanediamide?
N,N'-bis(oxolan-2-ylmethyl)pentanediamide has a molecular weight of 298.38 g/mol, XLogP of 0.75, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(oxolan-2-ylmethyl)pentanediamide is sourced from PubChem (CID 2930688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).