2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine

C11H26N2 — CID 170208010

IUPAC2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine
SMILESCNC(C)(C)CC(C)(C)NC(C)C
InChIInChI=1S/C11H26N2/c1-9(2)13-11(5,6)8-10(3,4)12-7/h9,12-13H,8H2,1-7H3
InChIKeyAHWVEYAQTMJGTK-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.15
Rot. Bonds5

About 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine

2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine (PubChem CID 170208010) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine.

Molecular Properties

Compound Name2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine
PubChem CID170208010
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Name2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine
SMILESCNC(C)(C)CC(C)(C)NC(C)C
InChIInChI=1S/C11H26N2/c1-9(2)13-11(5,6)8-10(3,4)12-7/h9,12-13H,8H2,1-7H3
InChIKeyAHWVEYAQTMJGTK-UHFFFAOYSA-N
XLogP2.15
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine?
The IUPAC name of 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine (CID 170208010) is 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine.
What is the SMILES notation for 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine?
The canonical SMILES for 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine is CNC(C)(C)CC(C)(C)NC(C)C.
What is the InChIKey of 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine?
The InChIKey is AHWVEYAQTMJGTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2/c1-9(2)13-11(5,6)8-10(3,4)12-7/h9,12-13H,8H2,1-7H3.
What are the key properties of 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine?
2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine has a molecular weight of 186.34 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2,4-trimethyl-4-N-propan-2-ylpentane-2,4-diamine is sourced from PubChem (CID 170208010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).