1-phosphorosocyclohexan-1-amine

C6H12NOP — CID 70377038

IUPAC1-phosphorosocyclohexan-1-amine
SMILESNC1(P=O)CCCCC1
InChIInChI=1S/C6H12NOP/c7-6(9-8)4-2-1-3-5-6/h1-5,7H2
InChIKeyHFIFEOCZQMZDFJ-UHFFFAOYSA-N
MW145.14 g/mol
LogP1.90
Rot. Bonds1

About 1-phosphorosocyclohexan-1-amine

1-phosphorosocyclohexan-1-amine (PubChem CID 70377038) has the molecular formula C6H12NOP and a molecular weight of 145.14 g/mol. Its IUPAC name is 1-phosphorosocyclohexan-1-amine.

Molecular Properties

Compound Name1-phosphorosocyclohexan-1-amine
PubChem CID70377038
Molecular FormulaC6H12NOP
Molecular Weight145.14 g/mol
Exact Mass145.07
IUPAC Name1-phosphorosocyclohexan-1-amine
SMILESNC1(P=O)CCCCC1
InChIInChI=1S/C6H12NOP/c7-6(9-8)4-2-1-3-5-6/h1-5,7H2
InChIKeyHFIFEOCZQMZDFJ-UHFFFAOYSA-N
XLogP1.90
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.14
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

bis(cyclodecane);cyclodecane-1,1-diamine
CID 22325955
cyclohexane-1,1-diamine;platinum(2+)
CID 22338759
1-(1-aminocyclohexyl)sulfonylcyclohexan-1-amine
CID 20526127
carbonic acid;cyclohexane-1,1-diamine
CID 175516465
CID 145159895
CID 145159895
1-iodocyclotridecan-1-amine
CID 134396656
1-aminocyclotridecane-1-carboxylic acid
CID 53441426
1-aminocyclohenicosane-1-carboxylic acid
CID 101359672
1-bis(1-aminocyclohexyl)stibanylcyclohexan-1-amine
CID 23462598
1-methylsulfonylcycloheptan-1-amine
CID 62473091
1-aminocyclohexane-1-carbaldehyde;ethane
CID 145148133
cyclohexane-1,1-diamine;dichloroplatinum
CID 21280166

Frequently Asked Questions

What is the IUPAC name of 1-phosphorosocyclohexan-1-amine?
The IUPAC name of 1-phosphorosocyclohexan-1-amine (CID 70377038) is 1-phosphorosocyclohexan-1-amine.
What is the SMILES notation for 1-phosphorosocyclohexan-1-amine?
The canonical SMILES for 1-phosphorosocyclohexan-1-amine is NC1(P=O)CCCCC1.
What is the InChIKey of 1-phosphorosocyclohexan-1-amine?
The InChIKey is HFIFEOCZQMZDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12NOP/c7-6(9-8)4-2-1-3-5-6/h1-5,7H2.
What are the key properties of 1-phosphorosocyclohexan-1-amine?
1-phosphorosocyclohexan-1-amine has a molecular weight of 145.14 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phosphorosocyclohexan-1-amine is sourced from PubChem (CID 70377038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).