N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine

C14H23N2P — CID 134256128

IUPACN-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine
SMILESCCN(C)CPC1(C)Nc2ccccc2C1C
InChIInChI=1S/C14H23N2P/c1-5-16(4)10-17-14(3)11(2)12-8-6-7-9-13(12)15-14/h6-9,11,15,17H,5,10H2,1-4H3
InChIKeyDBBIYGOEGKTTHO-UHFFFAOYSA-N
MW250.33 g/mol
LogP3.52
Rot. Bonds4

About N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine

N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine (PubChem CID 134256128) has the molecular formula C14H23N2P and a molecular weight of 250.33 g/mol. Its IUPAC name is N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine.

Molecular Properties

Compound NameN-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine
PubChem CID134256128
Molecular FormulaC14H23N2P
Molecular Weight250.33 g/mol
Exact Mass250.16
IUPAC NameN-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine
SMILESCCN(C)CPC1(C)Nc2ccccc2C1C
InChIInChI=1S/C14H23N2P/c1-5-16(4)10-17-14(3)11(2)12-8-6-7-9-13(12)15-14/h6-9,11,15,17H,5,10H2,1-4H3
InChIKeyDBBIYGOEGKTTHO-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine 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

Dicarbine
CID 65684
Indoline
CID 10328
1,3,3-Trimethyl-2-methyleneindoline
CID 8351
2-Methylindoline
CID 23305
2,3-dimethyl-2,3-dihydro-1H-indole
CID 30944
1-Methyl-2,3-dihydro-1H-indole
CID 55830
2-(2,3-Dihydro-1H-indol-3-yl)ethan-1-amine
CID 12655251
2-(2,3-Dihydro-1H-indol-5-yl)-1-methyl-ethylamine
CID 13660281
2,8-dimethyl-1H,2H,3H,4H,4aH,5H,9bH-pyrido[4,3-b]indole dihydrochloride
CID 134973
2-Indolinethione, 1,3-dimethyl-
CID 26157
Stobadine
CID 108089
5-Fluoroindoline
CID 2774463

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine?
The IUPAC name of N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine (CID 134256128) is N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine.
What is the SMILES notation for N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine?
The canonical SMILES for N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine is CCN(C)CPC1(C)Nc2ccccc2C1C.
What is the InChIKey of N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine?
The InChIKey is DBBIYGOEGKTTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N2P/c1-5-16(4)10-17-14(3)11(2)12-8-6-7-9-13(12)15-14/h6-9,11,15,17H,5,10H2,1-4H3.
What are the key properties of N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine?
N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine has a molecular weight of 250.33 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dimethyl-1,3-dihydroindol-2-yl)phosphanylmethyl]-N-methylethanamine is sourced from PubChem (CID 134256128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).