N-ethyl-N,2,4,4-tetramethylpentan-1-amine

C11H25N — CID 163702112

IUPACN-ethyl-N,2,4,4-tetramethylpentan-1-amine
SMILESCCN(C)CC(C)CC(C)(C)C
InChIInChI=1S/C11H25N/c1-7-12(6)9-10(2)8-11(3,4)5/h10H,7-9H2,1-6H3
InChIKeyKBXOLIDSWRULAQ-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.01
Rot. Bonds4

About N-ethyl-N,2,4,4-tetramethylpentan-1-amine

N-ethyl-N,2,4,4-tetramethylpentan-1-amine (PubChem CID 163702112) 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-1-amine.

Molecular Properties

Compound NameN-ethyl-N,2,4,4-tetramethylpentan-1-amine
PubChem CID163702112
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC NameN-ethyl-N,2,4,4-tetramethylpentan-1-amine
SMILESCCN(C)CC(C)CC(C)(C)C
InChIInChI=1S/C11H25N/c1-7-12(6)9-10(2)8-11(3,4)5/h10H,7-9H2,1-6H3
InChIKeyKBXOLIDSWRULAQ-UHFFFAOYSA-N
XLogP3.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,4-diethyl-N,2,4-trimethylhexan-1-amine
CID 123611396
(2S)-N-ethyl-N,2-dimethylbutan-1-amine
CID 89086806
N'-ethyl-N',2-dimethylpropane-1,3-diamine
CID 25219171
ethane;2,2,4,6,6-pentamethylheptane
CID 142211592
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
methane;2,2,4-trimethylhexane
CID 159659116
azane;2,2,4-trimethylhexane
CID 87634842
N-ethyl-N,2-dimethylpent-4-en-1-amine
CID 139352372
(2R)-1-[ethyl(methyl)amino]propane-2-thiol
CID 134269969
lithium 2,2,4-trimethylhexane
CID 19358976
Aluminum, hydrobis(2,4,4-trimethylpentyl)-
CID 16684520
propane;2,4,4-trimethylpentylphosphane
CID 174469111

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2,4,4-tetramethylpentan-1-amine?
The IUPAC name of N-ethyl-N,2,4,4-tetramethylpentan-1-amine (CID 163702112) is N-ethyl-N,2,4,4-tetramethylpentan-1-amine.
What is the SMILES notation for N-ethyl-N,2,4,4-tetramethylpentan-1-amine?
The canonical SMILES for N-ethyl-N,2,4,4-tetramethylpentan-1-amine is CCN(C)CC(C)CC(C)(C)C.
What is the InChIKey of N-ethyl-N,2,4,4-tetramethylpentan-1-amine?
The InChIKey is KBXOLIDSWRULAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-7-12(6)9-10(2)8-11(3,4)5/h10H,7-9H2,1-6H3.
What are the key properties of N-ethyl-N,2,4,4-tetramethylpentan-1-amine?
N-ethyl-N,2,4,4-tetramethylpentan-1-amine has a molecular weight of 171.33 g/mol, XLogP of 3.01, 4 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-1-amine is sourced from PubChem (CID 163702112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).