N-ethyl-N,2,4,4-tetramethylpentan-2-amine

C11H25N — CID 10702324

IUPACN-ethyl-N,2,4,4-tetramethylpentan-2-amine
SMILESCCN(C)C(C)(C)CC(C)(C)C
InChIInChI=1S/C11H25N/c1-8-12(7)11(5,6)9-10(2,3)4/h8-9H2,1-7H3
InChIKeyXPJHPBUICJMXTH-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.15
Rot. Bonds3

About N-ethyl-N,2,4,4-tetramethylpentan-2-amine

N-ethyl-N,2,4,4-tetramethylpentan-2-amine (PubChem CID 10702324) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is N-ethyl-N,2,4,4-tetramethylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-N,2,4,4-tetramethylpentan-2-amine
PubChem CID10702324
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC NameN-ethyl-N,2,4,4-tetramethylpentan-2-amine
SMILESCCN(C)C(C)(C)CC(C)(C)C
InChIInChI=1S/C11H25N/c1-8-12(7)11(5,6)9-10(2,3)4/h8-9H2,1-7H3
InChIKeyXPJHPBUICJMXTH-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2,4,4-tetramethylpentan-2-amine?
The IUPAC name of N-ethyl-N,2,4,4-tetramethylpentan-2-amine (CID 10702324) is N-ethyl-N,2,4,4-tetramethylpentan-2-amine.
What is the SMILES notation for N-ethyl-N,2,4,4-tetramethylpentan-2-amine?
The canonical SMILES for N-ethyl-N,2,4,4-tetramethylpentan-2-amine is CCN(C)C(C)(C)CC(C)(C)C.
What is the InChIKey of N-ethyl-N,2,4,4-tetramethylpentan-2-amine?
The InChIKey is XPJHPBUICJMXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-8-12(7)11(5,6)9-10(2,3)4/h8-9H2,1-7H3.
What are the key properties of N-ethyl-N,2,4,4-tetramethylpentan-2-amine?
N-ethyl-N,2,4,4-tetramethylpentan-2-amine has a molecular weight of 171.33 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2,4,4-tetramethylpentan-2-amine is sourced from PubChem (CID 10702324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).