4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine

C13H20N6 — CID 103012384

IUPAC4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)cc(NCCc2ccnn2C)n1
InChIInChI=1S/C13H20N6/c1-3-4-12-17-11(14)9-13(18-12)15-7-5-10-6-8-16-19(10)2/h6,8-9H,3-5,7H2,1-2H3,(H3,14,15,17,18)
InChIKeyIFMCJEVWOBOCRB-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.40
Rot. Bonds6

About 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine

4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine (PubChem CID 103012384) has the molecular formula C13H20N6 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine
PubChem CID103012384
Molecular FormulaC13H20N6
Molecular Weight260.34 g/mol
Exact Mass260.17
IUPAC Name4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)cc(NCCc2ccnn2C)n1
InChIInChI=1S/C13H20N6/c1-3-4-12-17-11(14)9-13(18-12)15-7-5-10-6-8-16-19(10)2/h6,8-9H,3-5,7H2,1-2H3,(H3,14,15,17,18)
InChIKeyIFMCJEVWOBOCRB-UHFFFAOYSA-N
XLogP1.40
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-ethyl-4-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrimidine-4,6-diamine
CID 104925404
6-hydrazinyl-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidin-4-amine
CID 103012689
4-N-[2-(4-methoxyphenyl)ethyl]-2-propylpyrimidine-4,6-diamine
CID 80940431
6-chloro-4-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrimidine-2,4-diamine
CID 104695947
3-[(6-amino-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 80954273
4-N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 106041164
4-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propylpyrimidine-4,6-diamine
CID 80944222
1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-amine
CID 103001663
4-N-(3-ethoxypropyl)-2-propylpyrimidine-4,6-diamine
CID 80946334
2-[(6-amino-2-propylpyrimidin-4-yl)amino]ethylurea
CID 83118298
2-methyl-6-[2-(2-methylpyrazol-3-yl)ethylamino]pyridine-4-carbonitrile
CID 103007006
6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947336

Frequently Asked Questions

What is the IUPAC name of 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine (CID 103012384) is 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine is CCCc1nc(N)cc(NCCc2ccnn2C)n1.
What is the InChIKey of 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
The InChIKey is IFMCJEVWOBOCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6/c1-3-4-12-17-11(14)9-13(18-12)15-7-5-10-6-8-16-19(10)2/h6,8-9H,3-5,7H2,1-2H3,(H3,14,15,17,18).
What are the key properties of 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine?
4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine has a molecular weight of 260.34 g/mol, XLogP of 1.40, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 103012384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).