N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline

C19H18N2 — CID 139252241

IUPACN,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline
SMILESCN(C)c1ccc(-c2ccccc2)c(-c2ccccn2)c1
InChIInChI=1S/C19H18N2/c1-21(2)16-11-12-17(15-8-4-3-5-9-15)18(14-16)19-10-6-7-13-20-19/h3-14H,1-2H3
InChIKeyRXLQRNXFQMWNPN-UHFFFAOYSA-N
MW274.37 g/mol
LogP4.48
Rot. Bonds3

About N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline

N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline (PubChem CID 139252241) has the molecular formula C19H18N2 and a molecular weight of 274.37 g/mol. Its IUPAC name is N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline.

Molecular Properties

Compound NameN,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline
PubChem CID139252241
Molecular FormulaC19H18N2
Molecular Weight274.37 g/mol
Exact Mass274.15
IUPAC NameN,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline
SMILESCN(C)c1ccc(-c2ccccc2)c(-c2ccccn2)c1
InChIInChI=1S/C19H18N2/c1-21(2)16-11-12-17(15-8-4-3-5-9-15)18(14-16)19-10-6-7-13-20-19/h3-14H,1-2H3
InChIKeyRXLQRNXFQMWNPN-UHFFFAOYSA-N
XLogP4.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline?
The IUPAC name of N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline (CID 139252241) is N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline.
What is the SMILES notation for N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline?
The canonical SMILES for N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline is CN(C)c1ccc(-c2ccccc2)c(-c2ccccn2)c1.
What is the InChIKey of N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline?
The InChIKey is RXLQRNXFQMWNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2/c1-21(2)16-11-12-17(15-8-4-3-5-9-15)18(14-16)19-10-6-7-13-20-19/h3-14H,1-2H3.
What are the key properties of N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline?
N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline has a molecular weight of 274.37 g/mol, XLogP of 4.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-phenyl-3-pyridin-2-ylaniline is sourced from PubChem (CID 139252241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).