4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine

C14H22N6 — CID 56778067

IUPAC4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine
SMILESCc1cnn(CC(C)Nc2nc(C)cc(N(C)C)n2)c1
InChIInChI=1S/C14H22N6/c1-10-7-15-20(8-10)9-12(3)17-14-16-11(2)6-13(18-14)19(4)5/h6-8,12H,9H2,1-5H3,(H,16,17,18)
InChIKeyFQYCJLGWOUKLIX-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.86
Rot. Bonds5

About 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine

4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine (PubChem CID 56778067) has the molecular formula C14H22N6 and a molecular weight of 274.37 g/mol. Its IUPAC name is 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine
PubChem CID56778067
Molecular FormulaC14H22N6
Molecular Weight274.37 g/mol
Exact Mass274.19
IUPAC Name4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine
SMILESCc1cnn(CC(C)Nc2nc(C)cc(N(C)C)n2)c1
InChIInChI=1S/C14H22N6/c1-10-7-15-20(8-10)9-12(3)17-14-16-11(2)6-13(18-14)19(4)5/h6-8,12H,9H2,1-5H3,(H,16,17,18)
InChIKeyFQYCJLGWOUKLIX-UHFFFAOYSA-N
XLogP1.86
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine?
The IUPAC name of 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine (CID 56778067) is 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine is Cc1cnn(CC(C)Nc2nc(C)cc(N(C)C)n2)c1.
What is the InChIKey of 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine?
The InChIKey is FQYCJLGWOUKLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6/c1-10-7-15-20(8-10)9-12(3)17-14-16-11(2)6-13(18-14)19(4)5/h6-8,12H,9H2,1-5H3,(H,16,17,18).
What are the key properties of 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine?
4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine has a molecular weight of 274.37 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N,6-trimethyl-2-N-[1-(4-methylpyrazol-1-yl)propan-2-yl]pyrimidine-2,4-diamine is sourced from PubChem (CID 56778067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).