5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine

C19H26N2 — CID 174628687

IUPAC5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine
SMILESCCCN(CCC)c1ccc(CCc2ccccc2)cn1
InChIInChI=1S/C19H26N2/c1-3-14-21(15-4-2)19-13-12-18(16-20-19)11-10-17-8-6-5-7-9-17/h5-9,12-13,16H,3-4,10-11,14-15H2,1-2H3
InChIKeyVUFUERUQWIWHSB-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.49
Rot. Bonds8

About 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine

5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine (PubChem CID 174628687) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine.

Molecular Properties

Compound Name5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine
PubChem CID174628687
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine
SMILESCCCN(CCC)c1ccc(CCc2ccccc2)cn1
InChIInChI=1S/C19H26N2/c1-3-14-21(15-4-2)19-13-12-18(16-20-19)11-10-17-8-6-5-7-9-17/h5-9,12-13,16H,3-4,10-11,14-15H2,1-2H3
InChIKeyVUFUERUQWIWHSB-UHFFFAOYSA-N
XLogP4.49
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine?
The IUPAC name of 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine (CID 174628687) is 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine.
What is the SMILES notation for 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine?
The canonical SMILES for 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine is CCCN(CCC)c1ccc(CCc2ccccc2)cn1.
What is the InChIKey of 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine?
The InChIKey is VUFUERUQWIWHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-3-14-21(15-4-2)19-13-12-18(16-20-19)11-10-17-8-6-5-7-9-17/h5-9,12-13,16H,3-4,10-11,14-15H2,1-2H3.
What are the key properties of 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine?
5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine has a molecular weight of 282.43 g/mol, XLogP of 4.49, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenylethyl)-N,N-dipropylpyridin-2-amine is sourced from PubChem (CID 174628687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).