N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine

C14H32N2O — CID 43147003

IUPACN'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCOC(C)(C)CC(C)NCC(C)(C)CN(C)C
InChIInChI=1S/C14H32N2O/c1-12(9-14(4,5)17-8)15-10-13(2,3)11-16(6)7/h12,15H,9-11H2,1-8H3
InChIKeyLPCDBVVRBGWNAL-UHFFFAOYSA-N
MW244.42 g/mol
LogP2.37
Rot. Bonds8

About N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine

N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine (PubChem CID 43147003) has the molecular formula C14H32N2O and a molecular weight of 244.42 g/mol. Its IUPAC name is N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
PubChem CID43147003
Molecular FormulaC14H32N2O
Molecular Weight244.42 g/mol
Exact Mass244.25
IUPAC NameN'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCOC(C)(C)CC(C)NCC(C)(C)CN(C)C
InChIInChI=1S/C14H32N2O/c1-12(9-14(4,5)17-8)15-10-13(2,3)11-16(6)7/h12,15H,9-11H2,1-8H3
InChIKeyLPCDBVVRBGWNAL-UHFFFAOYSA-N
XLogP2.37
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.42
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The IUPAC name of N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine (CID 43147003) is N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The canonical SMILES for N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine is COC(C)(C)CC(C)NCC(C)(C)CN(C)C.
What is the InChIKey of N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The InChIKey is LPCDBVVRBGWNAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O/c1-12(9-14(4,5)17-8)15-10-13(2,3)11-16(6)7/h12,15H,9-11H2,1-8H3.
What are the key properties of N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine has a molecular weight of 244.42 g/mol, XLogP of 2.37, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methoxy-4-methylpentan-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 43147003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).