6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine

C15H24N6 — CID 80991956

IUPAC6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NC)c(C)c(NCCc2cnn(C)c2)n1
InChIInChI=1S/C15H24N6/c1-5-6-13-19-14(16-3)11(2)15(20-13)17-8-7-12-9-18-21(4)10-12/h9-10H,5-8H2,1-4H3,(H2,16,17,19,20)
InChIKeySTWVZCDUFDAKJY-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.17
Rot. Bonds7

About 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine

6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine (PubChem CID 80991956) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine
PubChem CID80991956
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NC)c(C)c(NCCc2cnn(C)c2)n1
InChIInChI=1S/C15H24N6/c1-5-6-13-19-14(16-3)11(2)15(20-13)17-8-7-12-9-18-21(4)10-12/h9-10H,5-8H2,1-4H3,(H2,16,17,19,20)
InChIKeySTWVZCDUFDAKJY-UHFFFAOYSA-N
XLogP2.17
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-4-N-[(1-methylpyrazol-4-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 80982724
N-ethyl-5-methyl-6-(1-methylpyrazol-4-yl)-2-propylpyrimidin-4-amine
CID 80975348
3-[[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-1-ol
CID 80981891
6-methyl-2-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,3-diamine
CID 81131882
1-methyl-4-propylpyrazole;propane
CID 155742221
2-ethyl-6-N,5-dimethyl-4-N-(1-methylpyrazol-4-yl)pyrimidine-4,6-diamine
CID 80992962
2-ethyl-6-N,5-dimethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-4,6-diamine
CID 80987116
6-hydrazinyl-5-methyl-N-(1-methylpyrazol-4-yl)-2-propylpyrimidin-4-amine
CID 81006835
6-N,5-dimethyl-4-N-[(6-methyl-3-pyridinyl)methyl]-2-propylpyrimidine-4,6-diamine
CID 80985315
N-ethyl-2-[[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]ethanesulfonamide
CID 106343430
N,5-dimethyl-6-(4-methylpyrazol-1-yl)-2-propylpyrimidin-4-amine
CID 80992979
4-N,2,5-trimethyl-4-N-[(1-methylpyrazol-4-yl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80779198

Frequently Asked Questions

What is the IUPAC name of 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine (CID 80991956) is 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine is CCCc1nc(NC)c(C)c(NCCc2cnn(C)c2)n1.
What is the InChIKey of 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
The InChIKey is STWVZCDUFDAKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-5-6-13-19-14(16-3)11(2)15(20-13)17-8-7-12-9-18-21(4)10-12/h9-10H,5-8H2,1-4H3,(H2,16,17,19,20).
What are the key properties of 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine has a molecular weight of 288.40 g/mol, XLogP of 2.17, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,5-dimethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80991956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).