1-aminophosphanylpiperidine-3-carboxamide;methane

C7H18N3OP — CID 142847668

IUPAC1-aminophosphanylpiperidine-3-carboxamide;methane
SMILESC.NPN1CCCC(C(N)=O)C1
InChIInChI=1S/C6H14N3OP.CH4/c7-6(10)5-2-1-3-9(4-5)11-8;/h5,11H,1-4,8H2,(H2,7,10);1H4
InChIKeyVWHRRNBKVHVEJT-UHFFFAOYSA-N
MW191.21 g/mol
LogP0.29
Rot. Bonds2

About 1-aminophosphanylpiperidine-3-carboxamide;methane

1-aminophosphanylpiperidine-3-carboxamide;methane (PubChem CID 142847668) has the molecular formula C7H18N3OP and a molecular weight of 191.21 g/mol. Its IUPAC name is 1-aminophosphanylpiperidine-3-carboxamide;methane.

Molecular Properties

Compound Name1-aminophosphanylpiperidine-3-carboxamide;methane
PubChem CID142847668
Molecular FormulaC7H18N3OP
Molecular Weight191.21 g/mol
Exact Mass191.12
IUPAC Name1-aminophosphanylpiperidine-3-carboxamide;methane
SMILESC.NPN1CCCC(C(N)=O)C1
InChIInChI=1S/C6H14N3OP.CH4/c7-6(10)5-2-1-3-9(4-5)11-8;/h5,11H,1-4,8H2,(H2,7,10);1H4
InChIKeyVWHRRNBKVHVEJT-UHFFFAOYSA-N
XLogP0.29
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.21
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-methanidylpiperidine-3-carboxamide
CID 23545608
CID 88930738
CID 88930738
1-sulfamoylpiperidine-3-carboxamide
CID 43132049
(3R)-1-propan-2-ylpiperidine-3-carboxamide
CID 58431105
1-tert-butylpiperidine-3-carboxamide
CID 59656300
1-(hydrazinecarbonyl)piperidine-3-carboxamide
CID 43164061
(3R)-1-methylsulfonylpiperidine-3-carboxamide
CID 92512001
1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide
CID 126972262
1-piperidin-1-ylsulfonylpiperidine-3-carboxamide
CID 47149029
1-(2-chloroethyl)piperidine-3-carboxamide
CID 61287310
(3R)-1-(2-chloroacetyl)piperidine-3-carboxamide
CID 9115268
1-(2-hydroxycyclopentyl)piperidine-3-carboxamide
CID 60712103

Frequently Asked Questions

What is the IUPAC name of 1-aminophosphanylpiperidine-3-carboxamide;methane?
The IUPAC name of 1-aminophosphanylpiperidine-3-carboxamide;methane (CID 142847668) is 1-aminophosphanylpiperidine-3-carboxamide;methane.
What is the SMILES notation for 1-aminophosphanylpiperidine-3-carboxamide;methane?
The canonical SMILES for 1-aminophosphanylpiperidine-3-carboxamide;methane is C.NPN1CCCC(C(N)=O)C1.
What is the InChIKey of 1-aminophosphanylpiperidine-3-carboxamide;methane?
The InChIKey is VWHRRNBKVHVEJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N3OP.CH4/c7-6(10)5-2-1-3-9(4-5)11-8;/h5,11H,1-4,8H2,(H2,7,10);1H4.
What are the key properties of 1-aminophosphanylpiperidine-3-carboxamide;methane?
1-aminophosphanylpiperidine-3-carboxamide;methane has a molecular weight of 191.21 g/mol, XLogP of 0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminophosphanylpiperidine-3-carboxamide;methane is sourced from PubChem (CID 142847668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).