(2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine

C5H13N2P — CID 126635833

IUPAC(2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine
SMILESC=PC[C@H](N)CNC
InChIInChI=1S/C5H13N2P/c1-7-3-5(6)4-8-2/h5,7H,2-4,6H2,1H3/t5-/m1/s1
InChIKeyGHBBXLOYOZPIRN-RXMQYKEDSA-N
MW132.15 g/mol
LogP-0.09
Rot. Bonds4

About (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine

(2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine (PubChem CID 126635833) has the molecular formula C5H13N2P and a molecular weight of 132.15 g/mol. Its IUPAC name is (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine.

Molecular Properties

Compound Name(2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine
PubChem CID126635833
Molecular FormulaC5H13N2P
Molecular Weight132.15 g/mol
Exact Mass132.08
IUPAC Name(2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine
SMILESC=PC[C@H](N)CNC
InChIInChI=1S/C5H13N2P/c1-7-3-5(6)4-8-2/h5,7H,2-4,6H2,1H3/t5-/m1/s1
InChIKeyGHBBXLOYOZPIRN-RXMQYKEDSA-N
XLogP-0.09
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.15
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 547031
CID 547031
CID 13743611
CID 13743611
CID 54434545
CID 54434545
CID 12573496
CID 12573496
CID 18986483
CID 18986483
CID 54260709
CID 54260709
CID 57563284
CID 57563284
CID 59945505
CID 59945505
CID 83349931
CID 83349931
CID 89404760
CID 89404760
CID 96955502
CID 96955502
CID 138713984
CID 138713984

Frequently Asked Questions

What is the IUPAC name of (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine?
The IUPAC name of (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine (CID 126635833) is (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine.
What is the SMILES notation for (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine?
The canonical SMILES for (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine is C=PC[C@H](N)CNC.
What is the InChIKey of (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine?
The InChIKey is GHBBXLOYOZPIRN-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H13N2P/c1-7-3-5(6)4-8-2/h5,7H,2-4,6H2,1H3/t5-/m1/s1.
What are the key properties of (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine?
(2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine has a molecular weight of 132.15 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-N-methyl-3-methylidenephosphanylpropane-1,2-diamine is sourced from PubChem (CID 126635833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).