N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine

C23H20N4 — CID 16662604

IUPACN-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine
SMILESc1cncc(Nc2cccc(CC(c3cccnc3)c3cccnc3)c2)c1
InChIInChI=1S/C23H20N4/c1-5-18(13-21(8-1)27-22-9-4-12-26-17-22)14-23(19-6-2-10-24-15-19)20-7-3-11-25-16-20/h1-13,15-17,23,27H,14H2
InChIKeyBOSJHYXSFWDQHP-UHFFFAOYSA-N
MW352.44 g/mol
LogP4.99
Rot. Bonds6

About N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine

N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine (PubChem CID 16662604) has the molecular formula C23H20N4 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine.

Molecular Properties

Compound NameN-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine
PubChem CID16662604
Molecular FormulaC23H20N4
Molecular Weight352.44 g/mol
Exact Mass352.17
IUPAC NameN-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine
SMILESc1cncc(Nc2cccc(CC(c3cccnc3)c3cccnc3)c2)c1
InChIInChI=1S/C23H20N4/c1-5-18(13-21(8-1)27-22-9-4-12-26-17-22)14-23(19-6-2-10-24-15-19)20-7-3-11-25-16-20/h1-13,15-17,23,27H,14H2
InChIKeyBOSJHYXSFWDQHP-UHFFFAOYSA-N
XLogP4.99
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-(pyridin-3-ylamino)phenyl]prop-1-en-1-one
CID 91393664
3-[3-(2,2-dipyridin-3-ylethyl)phenyl]oxadiazol-3-ium-5-olate
CID 66829924
3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine
CID 176898824
(1R)-2-phenyl-1-pyridin-3-ylethanol
CID 93312258
3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine
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3-[1-chloro-2-(3-chlorophenyl)ethyl]pyridine
CID 63016855
3-[1-bromo-2-(3-bromophenyl)ethyl]pyridine
CID 63018745
N-[3-(2,2-dipyridin-3-ylethyl)-2-pyridinyl]quinoxalin-6-amine
CID 16662857
[2-(3-methylphenyl)-1-pyridin-3-ylethyl]hydrazine
CID 105196124
N-(3,4-dimethylphenyl)pyridin-3-amine
CID 82537517
2-phenyl-1-pyridin-3-ylethanamine
CID 10352711
(1S)-2-phenyl-1-pyridin-3-ylethanamine
CID 93312491

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine?
The IUPAC name of N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine (CID 16662604) is N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine.
What is the SMILES notation for N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine?
The canonical SMILES for N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine is c1cncc(Nc2cccc(CC(c3cccnc3)c3cccnc3)c2)c1.
What is the InChIKey of N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine?
The InChIKey is BOSJHYXSFWDQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4/c1-5-18(13-21(8-1)27-22-9-4-12-26-17-22)14-23(19-6-2-10-24-15-19)20-7-3-11-25-16-20/h1-13,15-17,23,27H,14H2.
What are the key properties of N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine?
N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine has a molecular weight of 352.44 g/mol, XLogP of 4.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,2-dipyridin-3-ylethyl)phenyl]pyridin-3-amine is sourced from PubChem (CID 16662604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).