(1-methylpyrrolidin-2-ylidene)phosphane

C5H10NP — CID 12856498

IUPAC(1-methylpyrrolidin-2-ylidene)phosphane
SMILES[H]/P=C1\CCCN1C
InChIInChI=1S/C5H10NP/c1-6-4-2-3-5(6)7/h7H,2-4H2,1H3
InChIKeyXZSQDHODPGSRCE-UHFFFAOYSA-N
MW115.12 g/mol
LogP0.98
Rot. Bonds

About (1-methylpyrrolidin-2-ylidene)phosphane

(1-methylpyrrolidin-2-ylidene)phosphane (PubChem CID 12856498) has the molecular formula C5H10NP and a molecular weight of 115.12 g/mol. Its IUPAC name is (1-methylpyrrolidin-2-ylidene)phosphane.

Molecular Properties

Compound Name(1-methylpyrrolidin-2-ylidene)phosphane
PubChem CID12856498
Molecular FormulaC5H10NP
Molecular Weight115.12 g/mol
Exact Mass115.06
IUPAC Name(1-methylpyrrolidin-2-ylidene)phosphane
SMILES[H]/P=C1\CCCN1C
InChIInChI=1S/C5H10NP/c1-6-4-2-3-5(6)7/h7H,2-4H2,1H3
InChIKeyXZSQDHODPGSRCE-UHFFFAOYSA-N
XLogP0.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.12
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-methylpyrrolidin-2-ylidene)phosphane?
The IUPAC name of (1-methylpyrrolidin-2-ylidene)phosphane (CID 12856498) is (1-methylpyrrolidin-2-ylidene)phosphane.
What is the SMILES notation for (1-methylpyrrolidin-2-ylidene)phosphane?
The canonical SMILES for (1-methylpyrrolidin-2-ylidene)phosphane is [H]/P=C1\CCCN1C.
What is the InChIKey of (1-methylpyrrolidin-2-ylidene)phosphane?
The InChIKey is XZSQDHODPGSRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NP/c1-6-4-2-3-5(6)7/h7H,2-4H2,1H3.
What are the key properties of (1-methylpyrrolidin-2-ylidene)phosphane?
(1-methylpyrrolidin-2-ylidene)phosphane has a molecular weight of 115.12 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrrolidin-2-ylidene)phosphane is sourced from PubChem (CID 12856498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).