5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine

C20H16N6 — CID 118603090

IUPAC5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine
SMILESCc1ncc(-c2ccc(-c3ccccc3-c3cnc(N)nc3)cn2)cn1
InChIInChI=1S/C20H16N6/c1-13-22-11-16(12-23-13)19-7-6-14(8-24-19)17-4-2-3-5-18(17)15-9-25-20(21)26-10-15/h2-12H,1H3,(H2,21,25,26)
InChIKeyHNEABSCMVUBWDF-UHFFFAOYSA-N
MW340.39 g/mol
LogP3.55
Rot. Bonds3

About 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine

5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine (PubChem CID 118603090) has the molecular formula C20H16N6 and a molecular weight of 340.39 g/mol. Its IUPAC name is 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine
PubChem CID118603090
Molecular FormulaC20H16N6
Molecular Weight340.39 g/mol
Exact Mass340.14
IUPAC Name5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine
SMILESCc1ncc(-c2ccc(-c3ccccc3-c3cnc(N)nc3)cn2)cn1
InChIInChI=1S/C20H16N6/c1-13-22-11-16(12-23-13)19-7-6-14(8-24-19)17-4-2-3-5-18(17)15-9-25-20(21)26-10-15/h2-12H,1H3,(H2,21,25,26)
InChIKeyHNEABSCMVUBWDF-UHFFFAOYSA-N
XLogP3.55
TPSA90.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Amprolium Hydrochloride
CID 8732
Azd-3839
CID 46202416
Amprolium
CID 73341
2-Amino-4-phenylpyrimidine
CID 598777
Fanotaprim
CID 134812633
Amprolium ion
CID 2178
N-benzyl-2-(pyridin-3-yl)quinazolin-4-amine
CID 667555
Tt-301
CID 54576073
Jnj-38893777
CID 16742146
(4-tert-Butyl-phenyl)-[7-(3-trifluoromethyl-pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-yl]-amine
CID 24782891
2-isopropyl-7-(3-(trifluoromethyl)pyridin-2-yl)-N-(5-(trifluoromethyl)pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[5,4-d]azepin-4-amine
CID 52949700
Sri-9439
CID 446752

Frequently Asked Questions

What is the IUPAC name of 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine?
The IUPAC name of 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine (CID 118603090) is 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine.
What is the SMILES notation for 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine?
The canonical SMILES for 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine is Cc1ncc(-c2ccc(-c3ccccc3-c3cnc(N)nc3)cn2)cn1.
What is the InChIKey of 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine?
The InChIKey is HNEABSCMVUBWDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6/c1-13-22-11-16(12-23-13)19-7-6-14(8-24-19)17-4-2-3-5-18(17)15-9-25-20(21)26-10-15/h2-12H,1H3,(H2,21,25,26).
What are the key properties of 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine?
5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine has a molecular weight of 340.39 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[6-(2-methylpyrimidin-5-yl)-3-pyridinyl]phenyl]pyrimidin-2-amine is sourced from PubChem (CID 118603090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).