N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine

C22H19N5 — CID 67062316

IUPACN-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine
SMILESCc1cccc(N(c2ccccc2)c2cc(-c3ccnc(N)c3)ccn2)n1
InChIInChI=1S/C22H19N5/c1-16-6-5-9-21(26-16)27(19-7-3-2-4-8-19)22-15-18(11-13-25-22)17-10-12-24-20(23)14-17/h2-15H,1H3,(H2,23,24)
InChIKeyOREAAXMOVPAHJO-UHFFFAOYSA-N
MW353.43 g/mol
LogP4.90
Rot. Bonds4

About N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine

N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine (PubChem CID 67062316) has the molecular formula C22H19N5 and a molecular weight of 353.43 g/mol. Its IUPAC name is N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine.

Molecular Properties

Compound NameN-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine
PubChem CID67062316
Molecular FormulaC22H19N5
Molecular Weight353.43 g/mol
Exact Mass353.16
IUPAC NameN-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine
SMILESCc1cccc(N(c2ccccc2)c2cc(-c3ccnc(N)c3)ccn2)n1
InChIInChI=1S/C22H19N5/c1-16-6-5-9-21(26-16)27(19-7-3-2-4-8-19)22-15-18(11-13-25-22)17-10-12-24-20(23)14-17/h2-15H,1H3,(H2,23,24)
InChIKeyOREAAXMOVPAHJO-UHFFFAOYSA-N
XLogP4.90
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine?
The IUPAC name of N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine (CID 67062316) is N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine.
What is the SMILES notation for N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine?
The canonical SMILES for N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine is Cc1cccc(N(c2ccccc2)c2cc(-c3ccnc(N)c3)ccn2)n1.
What is the InChIKey of N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine?
The InChIKey is OREAAXMOVPAHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5/c1-16-6-5-9-21(26-16)27(19-7-3-2-4-8-19)22-15-18(11-13-25-22)17-10-12-24-20(23)14-17/h2-15H,1H3,(H2,23,24).
What are the key properties of N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine?
N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine has a molecular weight of 353.43 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-4-pyridinyl)-2-pyridinyl]-6-methyl-N-phenylpyridin-2-amine is sourced from PubChem (CID 67062316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).