2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine

C14H20N6 — CID 50955144

IUPAC2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine
SMILESCc1nc(N(C)C)nc(N(C)Cc2cnccn2)c1C
InChIInChI=1S/C14H20N6/c1-10-11(2)17-14(19(3)4)18-13(10)20(5)9-12-8-15-6-7-16-12/h6-8H,9H2,1-5H3
InChIKeyPJOHENFDBSBFDM-UHFFFAOYSA-N
MW272.36 g/mol
LogP1.59
Rot. Bonds4

About 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine

2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine (PubChem CID 50955144) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine
PubChem CID50955144
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC Name2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine
SMILESCc1nc(N(C)C)nc(N(C)Cc2cnccn2)c1C
InChIInChI=1S/C14H20N6/c1-10-11(2)17-14(19(3)4)18-13(10)20(5)9-12-8-15-6-7-16-12/h6-8H,9H2,1-5H3
InChIKeyPJOHENFDBSBFDM-UHFFFAOYSA-N
XLogP1.59
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine (CID 50955144) is 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine is Cc1nc(N(C)C)nc(N(C)Cc2cnccn2)c1C.
What is the InChIKey of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine?
The InChIKey is PJOHENFDBSBFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-10-11(2)17-14(19(3)4)18-13(10)20(5)9-12-8-15-6-7-16-12/h6-8H,9H2,1-5H3.
What are the key properties of 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine?
2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine has a molecular weight of 272.36 g/mol, XLogP of 1.59, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N,5,6-pentamethyl-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 50955144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).