2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide

C15H30N2O2 — CID 71852755

IUPAC2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide
SMILESCC(C)CC(CCC(=O)NC(C)C)C(=O)NC(C)C
InChIInChI=1S/C15H30N2O2/c1-10(2)9-13(15(19)17-12(5)6)7-8-14(18)16-11(3)4/h10-13H,7-9H2,1-6H3,(H,16,18)(H,17,19)
InChIKeyXTVHUZQAAWZFFR-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.48
Rot. Bonds8

About 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide

2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide (PubChem CID 71852755) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide.

Molecular Properties

Compound Name2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide
PubChem CID71852755
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide
SMILESCC(C)CC(CCC(=O)NC(C)C)C(=O)NC(C)C
InChIInChI=1S/C15H30N2O2/c1-10(2)9-13(15(19)17-12(5)6)7-8-14(18)16-11(3)4/h10-13H,7-9H2,1-6H3,(H,16,18)(H,17,19)
InChIKeyXTVHUZQAAWZFFR-UHFFFAOYSA-N
XLogP2.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide?
The IUPAC name of 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide (CID 71852755) is 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide.
What is the SMILES notation for 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide?
The canonical SMILES for 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide is CC(C)CC(CCC(=O)NC(C)C)C(=O)NC(C)C.
What is the InChIKey of 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide?
The InChIKey is XTVHUZQAAWZFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-10(2)9-13(15(19)17-12(5)6)7-8-14(18)16-11(3)4/h10-13H,7-9H2,1-6H3,(H,16,18)(H,17,19).
What are the key properties of 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide?
2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide has a molecular weight of 270.42 g/mol, XLogP of 2.48, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-N,N'-di(propan-2-yl)pentanediamide is sourced from PubChem (CID 71852755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).