N,2,2,4,4-pentamethylpentan-3-imine

C10H21N — CID 20684885

IUPACN,2,2,4,4-pentamethylpentan-3-imine
SMILESCN=C(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C10H21N/c1-9(2,3)8(11-7)10(4,5)6/h1-7H3
InChIKeyOTZWZQBOHLYDOY-UHFFFAOYSA-N
MW155.28 g/mol
LogP3.15
Rot. Bonds

About N,2,2,4,4-pentamethylpentan-3-imine

N,2,2,4,4-pentamethylpentan-3-imine (PubChem CID 20684885) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N,2,2,4,4-pentamethylpentan-3-imine.

Molecular Properties

Compound NameN,2,2,4,4-pentamethylpentan-3-imine
PubChem CID20684885
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN,2,2,4,4-pentamethylpentan-3-imine
SMILESCN=C(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C10H21N/c1-9(2,3)8(11-7)10(4,5)6/h1-7H3
InChIKeyOTZWZQBOHLYDOY-UHFFFAOYSA-N
XLogP3.15
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,2,2,4,4-pentamethylpentan-3-imine?
The IUPAC name of N,2,2,4,4-pentamethylpentan-3-imine (CID 20684885) is N,2,2,4,4-pentamethylpentan-3-imine.
What is the SMILES notation for N,2,2,4,4-pentamethylpentan-3-imine?
The canonical SMILES for N,2,2,4,4-pentamethylpentan-3-imine is CN=C(C(C)(C)C)C(C)(C)C.
What is the InChIKey of N,2,2,4,4-pentamethylpentan-3-imine?
The InChIKey is OTZWZQBOHLYDOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-9(2,3)8(11-7)10(4,5)6/h1-7H3.
What are the key properties of N,2,2,4,4-pentamethylpentan-3-imine?
N,2,2,4,4-pentamethylpentan-3-imine has a molecular weight of 155.28 g/mol, XLogP of 3.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2,4,4-pentamethylpentan-3-imine is sourced from PubChem (CID 20684885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).