dipropylphosphane;ethane;5-ethyl-2-methylpyridine

C16H32NP — CID 143652926

IUPACdipropylphosphane;ethane;5-ethyl-2-methylpyridine
SMILESCC.CCCPCCC.CCc1ccc(C)nc1
InChIInChI=1S/C8H11N.C6H15P.C2H6/c1-3-8-5-4-7(2)9-6-8;1-3-5-7-6-4-2;1-2/h4-6H,3H2,1-2H3;7H,3-6H2,1-2H3;1-2H3
InChIKeySMATWEJZMDKRDX-UHFFFAOYSA-N
MW269.41 g/mol
LogP5.46
Rot. Bonds5

About dipropylphosphane;ethane;5-ethyl-2-methylpyridine

dipropylphosphane;ethane;5-ethyl-2-methylpyridine (PubChem CID 143652926) has the molecular formula C16H32NP and a molecular weight of 269.41 g/mol. Its IUPAC name is dipropylphosphane;ethane;5-ethyl-2-methylpyridine.

Molecular Properties

Compound Namedipropylphosphane;ethane;5-ethyl-2-methylpyridine
PubChem CID143652926
Molecular FormulaC16H32NP
Molecular Weight269.41 g/mol
Exact Mass269.23
IUPAC Namedipropylphosphane;ethane;5-ethyl-2-methylpyridine
SMILESCC.CCCPCCC.CCc1ccc(C)nc1
InChIInChI=1S/C8H11N.C6H15P.C2H6/c1-3-8-5-4-7(2)9-6-8;1-3-5-7-6-4-2;1-2/h4-6H,3H2,1-2H3;7H,3-6H2,1-2H3;1-2H3
InChIKeySMATWEJZMDKRDX-UHFFFAOYSA-N
XLogP5.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.41
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dipropylphosphane;ethane;5-ethyl-2-methylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-dimethylpyrimidine;5-ethyl-2-methylpyridine
CID 142030159
ethane;5-(4-ethylphenyl)-2-methylpyridine
CID 143418091
5-ethyl-2-methylpyridine;nitric acid
CID 157098676
5-ethyl-2-methylpyridine;propane-1-sulfonic acid
CID 174474831
2-tert-butyl-5-ethylpyrimidine;ethane;(6-methyl-3-pyridinyl)methanamine
CID 168923800
(6-methyl-3-pyridinyl)methanamine;hydrobromide
CID 133057273
N-(4-ethylphenyl)-2-(6-methyl-3-pyridinyl)acetamide
CID 47259711
ethane;2-methyl-5-(propan-2-yloxymethyl)pyridine
CID 171518990
5-[(2,5-dimethylpyrrol-1-yl)methyl]-2-methylpyridine
CID 62993324
methoxymethane;(6-methyl-3-pyridinyl)methanol
CID 145375166
N-[(6-methyl-3-pyridinyl)methyl]heptan-1-amine
CID 62996508
(2R,3R,5S,6S)-2,3,5,6-tetrakis(5-ethyl-2-pyridinyl)piperazine
CID 132558431

Frequently Asked Questions

What is the IUPAC name of dipropylphosphane;ethane;5-ethyl-2-methylpyridine?
The IUPAC name of dipropylphosphane;ethane;5-ethyl-2-methylpyridine (CID 143652926) is dipropylphosphane;ethane;5-ethyl-2-methylpyridine.
What is the SMILES notation for dipropylphosphane;ethane;5-ethyl-2-methylpyridine?
The canonical SMILES for dipropylphosphane;ethane;5-ethyl-2-methylpyridine is CC.CCCPCCC.CCc1ccc(C)nc1.
What is the InChIKey of dipropylphosphane;ethane;5-ethyl-2-methylpyridine?
The InChIKey is SMATWEJZMDKRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C6H15P.C2H6/c1-3-8-5-4-7(2)9-6-8;1-3-5-7-6-4-2;1-2/h4-6H,3H2,1-2H3;7H,3-6H2,1-2H3;1-2H3.
What are the key properties of dipropylphosphane;ethane;5-ethyl-2-methylpyridine?
dipropylphosphane;ethane;5-ethyl-2-methylpyridine has a molecular weight of 269.41 g/mol, XLogP of 5.46, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dipropylphosphane;ethane;5-ethyl-2-methylpyridine is sourced from PubChem (CID 143652926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).