N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine

C11H26NOP — CID 129227904

IUPACN-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine
SMILESCC(C)CCOPN(C(C)C)C(C)C
InChIInChI=1S/C11H26NOP/c1-9(2)7-8-13-14-12(10(3)4)11(5)6/h9-11,14H,7-8H2,1-6H3
InChIKeyFRUITXZTSYYIOF-UHFFFAOYSA-N
MW219.31 g/mol
LogP3.68
Rot. Bonds7

About N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine

N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine (PubChem CID 129227904) has the molecular formula C11H26NOP and a molecular weight of 219.31 g/mol. Its IUPAC name is N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine
PubChem CID129227904
Molecular FormulaC11H26NOP
Molecular Weight219.31 g/mol
Exact Mass219.18
IUPAC NameN-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine
SMILESCC(C)CCOPN(C(C)C)C(C)C
InChIInChI=1S/C11H26NOP/c1-9(2)7-8-13-14-12(10(3)4)11(5)6/h9-11,14H,7-8H2,1-6H3
InChIKeyFRUITXZTSYYIOF-UHFFFAOYSA-N
XLogP3.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;1-methoxy-3-methylbutane
CID 144580604
1-methoxy-3-methylbutane;2-methylbutane;2-methylpropane
CID 158816620
3-methyl-1-[2-[2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butane
CID 118631027
gallane;3-methyl-1-(3-methylbutoxy)butane
CID 174967258
CID 148792664
CID 148792664
3-methylbutyl hypobromite
CID 141146646
3-methyl-1-(3-methylbutoxy)butane;molecular iodine
CID 131712143
3-methylbutoxygallane
CID 174485666
3-methylbutoxysilane
CID 123427672
N-[methyl(3-methylbutoxy)phosphanyl]-N-propan-2-ylpropan-2-amine
CID 139428185
methoxy 3-methylbutyl sulfate
CID 175102300
3-methylbutoxy(phenoxy)phosphane
CID 175046720

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine (CID 129227904) is N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine is CC(C)CCOPN(C(C)C)C(C)C.
What is the InChIKey of N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine?
The InChIKey is FRUITXZTSYYIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26NOP/c1-9(2)7-8-13-14-12(10(3)4)11(5)6/h9-11,14H,7-8H2,1-6H3.
What are the key properties of N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine?
N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine has a molecular weight of 219.31 g/mol, XLogP of 3.68, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutoxyphosphanyl)-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 129227904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).