N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine

C15H30NP — CID 15091554

IUPACN-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine
SMILESC/C(=C\P(C(C)C)C(C)C)NC1CCCCC1
InChIInChI=1S/C15H30NP/c1-12(2)17(13(3)4)11-14(5)16-15-9-7-6-8-10-15/h11-13,15-16H,6-10H2,1-5H3/b14-11+
InChIKeyBFXOHBUTQBTDRH-SDNWHVSQSA-N
MW255.39 g/mol
LogP5.07
Rot. Bonds5

About N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine

N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine (PubChem CID 15091554) has the molecular formula C15H30NP and a molecular weight of 255.39 g/mol. Its IUPAC name is N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine.

Molecular Properties

Compound NameN-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine
PubChem CID15091554
Molecular FormulaC15H30NP
Molecular Weight255.39 g/mol
Exact Mass255.21
IUPAC NameN-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine
SMILESC/C(=C\P(C(C)C)C(C)C)NC1CCCCC1
InChIInChI=1S/C15H30NP/c1-12(2)17(13(3)4)11-14(5)16-15-9-7-6-8-10-15/h11-13,15-16H,6-10H2,1-5H3/b14-11+
InChIKeyBFXOHBUTQBTDRH-SDNWHVSQSA-N
XLogP5.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500255.39
LogP ≤ 55.07
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

4-(Cyclohexylamino)-1-methyl-2,3-dihydro-1H-1lambda~5~-phosphole-1-thione
CID 319424
N-cyclohexyl-1-methyl-1-methylsulfanyl-2,3-dihydrophosphol-1-ium-4-amine
CID 21677427
N-prop-1-en-2-ylcyclohexanamine
CID 12418329
N-but-1-en-2-ylcyclohexanamine
CID 12705416
1,2,2,3,3,4,4,5,5,6,6-undecadeuterio-N-prop-1-en-2-ylcyclohexan-1-amine
CID 59578602
N-(Pent-1-en-2-yl)cyclohexanamine
CID 71422454
1-N-methyl-4-N-prop-1-en-2-ylcyclohexane-1,4-diamine
CID 89294364
N-hept-1-en-2-ylcyclohexanamine
CID 138548425
ethane;N-prop-1-en-2-ylcyclohexanamine
CID 142001996
N-methylcyclohexanamine;prop-1-en-2-amine
CID 142542122
2-methylprop-1-ene;N-prop-1-en-2-ylcyclohexanamine
CID 143490405
N-methylprop-1-en-2-amine;N-prop-1-en-2-ylcyclohexanamine
CID 143490439

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine?
The IUPAC name of N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine (CID 15091554) is N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine.
What is the SMILES notation for N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine?
The canonical SMILES for N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine is C/C(=C\P(C(C)C)C(C)C)NC1CCCCC1.
What is the InChIKey of N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine?
The InChIKey is BFXOHBUTQBTDRH-SDNWHVSQSA-N. The full InChI is InChI=1S/C15H30NP/c1-12(2)17(13(3)4)11-14(5)16-15-9-7-6-8-10-15/h11-13,15-16H,6-10H2,1-5H3/b14-11+.
What are the key properties of N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine?
N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine has a molecular weight of 255.39 g/mol, XLogP of 5.07, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-di(propan-2-yl)phosphanylprop-1-en-2-yl]cyclohexanamine is sourced from PubChem (CID 15091554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).