dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane

C15H22NP — CID 167088322

IUPACdimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane
SMILESC=P(C)(C)Cc1cccc2[nH]cc(CCC)c12
InChIInChI=1S/C15H22NP/c1-5-7-12-10-16-14-9-6-8-13(15(12)14)11-17(2,3)4/h6,8-10,16H,2,5,7,11H2,1,3-4H3
InChIKeyGURQLRAEMOADAC-UHFFFAOYSA-N
MW247.32 g/mol
LogP4.33
Rot. Bonds4

About dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane

dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane (PubChem CID 167088322) has the molecular formula C15H22NP and a molecular weight of 247.32 g/mol. Its IUPAC name is dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane.

Molecular Properties

Compound Namedimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane
PubChem CID167088322
Molecular FormulaC15H22NP
Molecular Weight247.32 g/mol
Exact Mass247.15
IUPAC Namedimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane
SMILESC=P(C)(C)Cc1cccc2[nH]cc(CCC)c12
InChIInChI=1S/C15H22NP/c1-5-7-12-10-16-14-9-6-8-13(15(12)14)11-17(2,3)4/h6,8-10,16H,2,5,7,11H2,1,3-4H3
InChIKeyGURQLRAEMOADAC-UHFFFAOYSA-N
XLogP4.33
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(diethylamino)ethyl]-1H-indol-4-ol;hydrochloride
CID 165362448
3-propyl-1H-pyrrolo[3,2-b]pyridine
CID 23521600
ethane;N-ethyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]propan-1-amine
CID 156836181
3-[2-(dodecylamino)ethyl]-1H-indol-4-ol
CID 167346455
3-(2-ethylsulfanylethyl)-4-fluoro-1H-indole
CID 167475243
4-propyl-1,2-dihydroindazol-3-one
CID 175336398
3-[2-[di(propan-2-yl)amino]ethyl]-1H-indol-4-ol;hydrochloride
CID 24802096
3-(2-ethylselanylethyl)-4-methoxy-1H-indole
CID 167475252
4-pentyl-3-phenyl-1H-indole
CID 52914929
4-ethyl-3-methylsulfanyl-1H-indole
CID 57002365
3-(4-ethoxy-1H-indol-3-yl)propan-1-amine
CID 83917405
2-[3-[2-[ethyl(methyl)amino]ethyl]-1H-indol-4-yl]ethyl hydrogen carbonate
CID 175425600

Frequently Asked Questions

What is the IUPAC name of dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane?
The IUPAC name of dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane (CID 167088322) is dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane.
What is the SMILES notation for dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane?
The canonical SMILES for dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane is C=P(C)(C)Cc1cccc2[nH]cc(CCC)c12.
What is the InChIKey of dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane?
The InChIKey is GURQLRAEMOADAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22NP/c1-5-7-12-10-16-14-9-6-8-13(15(12)14)11-17(2,3)4/h6,8-10,16H,2,5,7,11H2,1,3-4H3.
What are the key properties of dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane?
dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane has a molecular weight of 247.32 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-methylidene-[(3-propyl-1H-indol-4-yl)methyl]-λ5-phosphane is sourced from PubChem (CID 167088322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).