2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide

C11H24N4O2 — CID 66223014

IUPAC2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide
SMILESCNC(CCC(C)(NC(C)C)C(N)=O)C(N)=O
InChIInChI=1S/C11H24N4O2/c1-7(2)15-11(3,10(13)17)6-5-8(14-4)9(12)16/h7-8,14-15H,5-6H2,1-4H3,(H2,12,16)(H2,13,17)
InChIKeyDMINJJVFESIFBQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP-0.92
Rot. Bonds8

About 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide

2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide (PubChem CID 66223014) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide.

Molecular Properties

Compound Name2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide
PubChem CID66223014
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC Name2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide
SMILESCNC(CCC(C)(NC(C)C)C(N)=O)C(N)=O
InChIInChI=1S/C11H24N4O2/c1-7(2)15-11(3,10(13)17)6-5-8(14-4)9(12)16/h7-8,14-15H,5-6H2,1-4H3,(H2,12,16)(H2,13,17)
InChIKeyDMINJJVFESIFBQ-UHFFFAOYSA-N
XLogP-0.92
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-0.92
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide?
The IUPAC name of 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide (CID 66223014) is 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide.
What is the SMILES notation for 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide?
The canonical SMILES for 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide is CNC(CCC(C)(NC(C)C)C(N)=O)C(N)=O.
What is the InChIKey of 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide?
The InChIKey is DMINJJVFESIFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-7(2)15-11(3,10(13)17)6-5-8(14-4)9(12)16/h7-8,14-15H,5-6H2,1-4H3,(H2,12,16)(H2,13,17).
What are the key properties of 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide?
2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide has a molecular weight of 244.34 g/mol, XLogP of -0.92, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(methylamino)-2-(propan-2-ylamino)hexanediamide is sourced from PubChem (CID 66223014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).