5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine

C15H27N5 — CID 66904208

IUPAC5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine
SMILESCC1CCC(Nc2ncc(CCN(C)C)c(N)n2)CC1
InChIInChI=1S/C15H27N5/c1-11-4-6-13(7-5-11)18-15-17-10-12(14(16)19-15)8-9-20(2)3/h10-11,13H,4-9H2,1-3H3,(H3,16,17,18,19)
InChIKeyIFNJKGFBFIEWTR-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.15
Rot. Bonds5

About 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine

5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine (PubChem CID 66904208) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine
PubChem CID66904208
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine
SMILESCC1CCC(Nc2ncc(CCN(C)C)c(N)n2)CC1
InChIInChI=1S/C15H27N5/c1-11-4-6-13(7-5-11)18-15-17-10-12(14(16)19-15)8-9-20(2)3/h10-11,13H,4-9H2,1-3H3,(H3,16,17,18,19)
InChIKeyIFNJKGFBFIEWTR-UHFFFAOYSA-N
XLogP2.15
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine?
The IUPAC name of 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine (CID 66904208) is 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine?
The canonical SMILES for 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine is CC1CCC(Nc2ncc(CCN(C)C)c(N)n2)CC1.
What is the InChIKey of 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine?
The InChIKey is IFNJKGFBFIEWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-11-4-6-13(7-5-11)18-15-17-10-12(14(16)19-15)8-9-20(2)3/h10-11,13H,4-9H2,1-3H3,(H3,16,17,18,19).
What are the key properties of 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine?
5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine has a molecular weight of 277.42 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(dimethylamino)ethyl]-2-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 66904208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).