N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine

C11H26N2 — CID 59193160

IUPACN-butyl-N,N',N',2-tetramethylpropane-1,3-diamine
SMILESCCCCN(C)CC(C)CN(C)C
InChIInChI=1S/C11H26N2/c1-6-7-8-13(5)10-11(2)9-12(3)4/h11H,6-10H2,1-5H3
InChIKeyCXCJCVHICUKJEY-UHFFFAOYSA-N
MW186.34 g/mol
LogP1.92
Rot. Bonds7

About N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine

N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine (PubChem CID 59193160) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-butyl-N,N',N',2-tetramethylpropane-1,3-diamine
PubChem CID59193160
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC NameN-butyl-N,N',N',2-tetramethylpropane-1,3-diamine
SMILESCCCCN(C)CC(C)CN(C)C
InChIInChI=1S/C11H26N2/c1-6-7-8-13(5)10-11(2)9-12(3)4/h11H,6-10H2,1-5H3
InChIKeyCXCJCVHICUKJEY-UHFFFAOYSA-N
XLogP1.92
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine?
The IUPAC name of N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine (CID 59193160) is N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine?
The canonical SMILES for N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine is CCCCN(C)CC(C)CN(C)C.
What is the InChIKey of N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine?
The InChIKey is CXCJCVHICUKJEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2/c1-6-7-8-13(5)10-11(2)9-12(3)4/h11H,6-10H2,1-5H3.
What are the key properties of N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine?
N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine has a molecular weight of 186.34 g/mol, XLogP of 1.92, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N,N',N',2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 59193160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).