N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine

C15H33N — CID 155428414

IUPACN-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine
SMILESCC(C(C)(C)C)C(C)(C)N(C)CC(C)(C)C
InChIInChI=1S/C15H33N/c1-12(14(5,6)7)15(8,9)16(10)11-13(2,3)4/h12H,11H2,1-10H3
InChIKeyZSZVISSRURGZAL-UHFFFAOYSA-N
MW227.44 g/mol
LogP4.43
Rot. Bonds3

About N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine

N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine (PubChem CID 155428414) has the molecular formula C15H33N and a molecular weight of 227.44 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine
PubChem CID155428414
Molecular FormulaC15H33N
Molecular Weight227.44 g/mol
Exact Mass227.26
IUPAC NameN-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine
SMILESCC(C(C)(C)C)C(C)(C)N(C)CC(C)(C)C
InChIInChI=1S/C15H33N/c1-12(14(5,6)7)15(8,9)16(10)11-13(2,3)4/h12H,11H2,1-10H3
InChIKeyZSZVISSRURGZAL-UHFFFAOYSA-N
XLogP4.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.44
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine (CID 155428414) is N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine is CC(C(C)(C)C)C(C)(C)N(C)CC(C)(C)C.
What is the InChIKey of N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine?
The InChIKey is ZSZVISSRURGZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N/c1-12(14(5,6)7)15(8,9)16(10)11-13(2,3)4/h12H,11H2,1-10H3.
What are the key properties of N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine?
N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine has a molecular weight of 227.44 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-N,2,3,4,4-pentamethylpentan-2-amine is sourced from PubChem (CID 155428414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).