N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine

C19H21N — CID 23878

IUPACN,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine
SMILESCN(C)CCC1(c2ccccc2)C=Cc2ccccc21
InChIInChI=1S/C19H21N/c1-20(2)15-14-19(17-9-4-3-5-10-17)13-12-16-8-6-7-11-18(16)19/h3-13H,14-15H2,1-2H3
InChIKeyKAQPNQMPHIRKJJ-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.95
Rot. Bonds4

About N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine

N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine (PubChem CID 23878) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine
PubChem CID23878
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC NameN,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine
SMILESCN(C)CCC1(c2ccccc2)C=Cc2ccccc21
InChIInChI=1S/C19H21N/c1-20(2)15-14-19(17-9-4-3-5-10-17)13-12-16-8-6-7-11-18(16)19/h3-13H,14-15H2,1-2H3
InChIKeyKAQPNQMPHIRKJJ-UHFFFAOYSA-N
XLogP3.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine (CID 23878) is N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine is CN(C)CCC1(c2ccccc2)C=Cc2ccccc21.
What is the InChIKey of N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine?
The InChIKey is KAQPNQMPHIRKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N/c1-20(2)15-14-19(17-9-4-3-5-10-17)13-12-16-8-6-7-11-18(16)19/h3-13H,14-15H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine?
N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine has a molecular weight of 263.38 g/mol, XLogP of 3.95, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1-phenylinden-1-yl)ethanamine is sourced from PubChem (CID 23878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).