4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine

C10H18N4 — CID 80765801

IUPAC4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine
SMILESCC(C)Nc1ncnc(N)c1C(C)C
InChIInChI=1S/C10H18N4/c1-6(2)8-9(11)12-5-13-10(8)14-7(3)4/h5-7H,1-4H3,(H3,11,12,13,14)
InChIKeyFPXBYPSZADOANZ-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.00
Rot. Bonds3

About 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine

4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine (PubChem CID 80765801) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine
PubChem CID80765801
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine
SMILESCC(C)Nc1ncnc(N)c1C(C)C
InChIInChI=1S/C10H18N4/c1-6(2)8-9(11)12-5-13-10(8)14-7(3)4/h5-7H,1-4H3,(H3,11,12,13,14)
InChIKeyFPXBYPSZADOANZ-UHFFFAOYSA-N
XLogP2.00
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(3,3-dimethylbutan-2-yl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 104830574
4-N-(4-methylpentan-2-yl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80782939
6-hydrazinyl-N,5-di(propan-2-yl)pyrimidin-4-amine
CID 80932454
4-N-ethyl-5-propan-2-ylpyrimidine-4,6-diamine
CID 80770662
6-(2,2-dimethylhydrazinyl)-5-propan-2-ylpyrimidin-4-amine
CID 83027191
5-propan-2-yl-4-N-(1-pyridin-4-ylethyl)pyrimidine-4,6-diamine
CID 80780923
4-[(6-amino-5-propan-2-ylpyrimidin-4-yl)amino]pentan-1-ol
CID 80852599
2-[(6-amino-5-propan-2-ylpyrimidin-4-yl)amino]-3-methoxypropan-1-ol
CID 106198795
4-N-(3-methyl-2-propan-2-ylbutyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 102908901
5-propan-2-yl-4-N-(1-pyridin-3-ylethyl)pyrimidine-4,6-diamine
CID 80779879
5-propan-2-yl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80785534
4-N-(2-methylbutan-2-yl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80767834

Frequently Asked Questions

What is the IUPAC name of 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine?
The IUPAC name of 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine (CID 80765801) is 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine?
The canonical SMILES for 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine is CC(C)Nc1ncnc(N)c1C(C)C.
What is the InChIKey of 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine?
The InChIKey is FPXBYPSZADOANZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-6(2)8-9(11)12-5-13-10(8)14-7(3)4/h5-7H,1-4H3,(H3,11,12,13,14).
What are the key properties of 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine?
4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine has a molecular weight of 194.28 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,5-di(propan-2-yl)pyrimidine-4,6-diamine is sourced from PubChem (CID 80765801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).