N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine

C14H20N2P2 — CID 91263529

IUPACN-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine
SMILESCN(C)Pc1cccc2cccc(PN(C)C)c12
InChIInChI=1S/C14H20N2P2/c1-15(2)17-12-9-5-7-11-8-6-10-13(14(11)12)18-16(3)4/h5-10,17-18H,1-4H3
InChIKeyIOFLLVGYMKEFNI-UHFFFAOYSA-N
MW278.28 g/mol
LogP2.40
Rot. Bonds4

About N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine

N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine (PubChem CID 91263529) has the molecular formula C14H20N2P2 and a molecular weight of 278.28 g/mol. Its IUPAC name is N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine.

Molecular Properties

Compound NameN-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine
PubChem CID91263529
Molecular FormulaC14H20N2P2
Molecular Weight278.28 g/mol
Exact Mass278.11
IUPAC NameN-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine
SMILESCN(C)Pc1cccc2cccc(PN(C)C)c12
InChIInChI=1S/C14H20N2P2/c1-15(2)17-12-9-5-7-11-8-6-10-13(14(11)12)18-16(3)4/h5-10,17-18H,1-4H3
InChIKeyIOFLLVGYMKEFNI-UHFFFAOYSA-N
XLogP2.40
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine?
The IUPAC name of N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine (CID 91263529) is N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine.
What is the SMILES notation for N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine?
The canonical SMILES for N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine is CN(C)Pc1cccc2cccc(PN(C)C)c12.
What is the InChIKey of N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine?
The InChIKey is IOFLLVGYMKEFNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2P2/c1-15(2)17-12-9-5-7-11-8-6-10-13(14(11)12)18-16(3)4/h5-10,17-18H,1-4H3.
What are the key properties of N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine?
N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine has a molecular weight of 278.28 g/mol, XLogP of 2.40, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-(dimethylaminophosphanyl)naphthalen-1-yl]phosphanyl-N-methylmethanamine is sourced from PubChem (CID 91263529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).