2-dicyclohexylphosphanylethanamine

C14H28NP — CID 77068327

IUPAC2-dicyclohexylphosphanylethanamine
SMILESNCCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C14H28NP/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12,15H2
InChIKeyMBJWFXNTNNVPIO-UHFFFAOYSA-N
MW241.36 g/mol
LogP4.09
Rot. Bonds4

About 2-dicyclohexylphosphanylethanamine

2-dicyclohexylphosphanylethanamine (PubChem CID 77068327) has the molecular formula C14H28NP and a molecular weight of 241.36 g/mol. Its IUPAC name is 2-dicyclohexylphosphanylethanamine.

Molecular Properties

Compound Name2-dicyclohexylphosphanylethanamine
PubChem CID77068327
Molecular FormulaC14H28NP
Molecular Weight241.36 g/mol
Exact Mass241.20
IUPAC Name2-dicyclohexylphosphanylethanamine
SMILESNCCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C14H28NP/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12,15H2
InChIKeyMBJWFXNTNNVPIO-UHFFFAOYSA-N
XLogP4.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-dicyclohexylphosphanylpropan-1-amine
CID 68903820
2-dicyclohexylphosphanylethanol
CID 154117829
dicyclohexyl-[3-[cyclohexyl(3-dicyclohexylphosphanylpropyl)phosphanyl]propyl]phosphane
CID 90108196
chloro(dihydrido)iridium;bis(2-dicyclohexylphosphanyl-N-(2-dicyclohexylphosphanylethyl)ethanamine)
CID 158559176
dicyclohexyl(6-phosphanylhexyl)phosphane
CID 151871346
chloroplatinum(1+);dicyclohexyl(2-dicyclohexylphosphanylethyl)phosphane;2-methanidyl-2-methylpropane
CID 15830283
dicyclohexyl(3-cyclopenta-2,4-dien-1-ylpropyl)phosphane
CID 101105057
di(cyclobutyl)-octylphosphane
CID 151646814
tri(cyclododecyl)phosphane
CID 19065577
tri(cyclooctyl)phosphane
CID 12970661
cyclohexyl-[4-[cyclohexyl(methyl)phosphanyl]butyl]-methylphosphane
CID 90057473
6-dicyclohexylphosphanyl-3-(3-dicyclohexylphosphanylpropyl)-2-methylhex-3-en-2-amine
CID 57155539

Frequently Asked Questions

What is the IUPAC name of 2-dicyclohexylphosphanylethanamine?
The IUPAC name of 2-dicyclohexylphosphanylethanamine (CID 77068327) is 2-dicyclohexylphosphanylethanamine.
What is the SMILES notation for 2-dicyclohexylphosphanylethanamine?
The canonical SMILES for 2-dicyclohexylphosphanylethanamine is NCCP(C1CCCCC1)C1CCCCC1.
What is the InChIKey of 2-dicyclohexylphosphanylethanamine?
The InChIKey is MBJWFXNTNNVPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28NP/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12,15H2.
What are the key properties of 2-dicyclohexylphosphanylethanamine?
2-dicyclohexylphosphanylethanamine has a molecular weight of 241.36 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dicyclohexylphosphanylethanamine is sourced from PubChem (CID 77068327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).