6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine

C20H19N7 — CID 133291049

IUPAC6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCc1cc(NCc2cccnc2-n2cccn2)nc(-c2ccccn2)n1
InChIInChI=1S/C20H19N7/c1-2-16-13-18(26-19(25-16)17-8-3-4-9-21-17)23-14-15-7-5-10-22-20(15)27-12-6-11-24-27/h3-13H,2,14H2,1H3,(H,23,25,26)
InChIKeyPCOCIGNYSMAZDX-UHFFFAOYSA-N
MW357.42 g/mol
LogP3.29
Rot. Bonds6

About 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine

6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 133291049) has the molecular formula C20H19N7 and a molecular weight of 357.42 g/mol. Its IUPAC name is 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID133291049
Molecular FormulaC20H19N7
Molecular Weight357.42 g/mol
Exact Mass357.17
IUPAC Name6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCc1cc(NCc2cccnc2-n2cccn2)nc(-c2ccccn2)n1
InChIInChI=1S/C20H19N7/c1-2-16-13-18(26-19(25-16)17-8-3-4-9-21-17)23-14-15-7-5-10-22-20(15)27-12-6-11-24-27/h3-13H,2,14H2,1H3,(H,23,25,26)
InChIKeyPCOCIGNYSMAZDX-UHFFFAOYSA-N
XLogP3.29
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 62191102
5-[[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]methyl]-N,N-dimethyl-1,2,4-oxadiazol-3-amine
CID 133487610
6-ethyl-2-pyridin-2-yl-N-[(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrimidin-4-amine
CID 133295366
6-ethyl-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133459201
N,6-dipropyl-2-pyridin-2-ylpyrimidin-4-amine
CID 62192681
N-[[(7R)-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl]-6-ethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 99805928
2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide
CID 133311048
6-ethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133294382
N-(1-benzylsulfonylpiperidin-4-yl)-6-ethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 133306579
N-benzyl-2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine
CID 1475716
6-ethyl-2-pyridin-2-yl-N-(1-thiophen-2-ylpropyl)pyrimidin-4-amine
CID 133336468
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine
CID 133444857

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine (CID 133291049) is 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine is CCc1cc(NCc2cccnc2-n2cccn2)nc(-c2ccccn2)n1.
What is the InChIKey of 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is PCOCIGNYSMAZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7/c1-2-16-13-18(26-19(25-16)17-8-3-4-9-21-17)23-14-15-7-5-10-22-20(15)27-12-6-11-24-27/h3-13H,2,14H2,1H3,(H,23,25,26).
What are the key properties of 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine?
6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 357.42 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 133291049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).