2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine

C14H25N5 — CID 23027628

IUPAC2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine
SMILESCc1nc(NC2CCC(N)CC2)nc(N(C)C)c1C
InChIInChI=1S/C14H25N5/c1-9-10(2)16-14(18-13(9)19(3)4)17-12-7-5-11(15)6-8-12/h11-12H,5-8,15H2,1-4H3,(H,16,17,18)
InChIKeyBQROFQLTGBOWFF-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.84
Rot. Bonds3

About 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine

2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine (PubChem CID 23027628) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine
PubChem CID23027628
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine
SMILESCc1nc(NC2CCC(N)CC2)nc(N(C)C)c1C
InChIInChI=1S/C14H25N5/c1-9-10(2)16-14(18-13(9)19(3)4)17-12-7-5-11(15)6-8-12/h11-12H,5-8,15H2,1-4H3,(H,16,17,18)
InChIKeyBQROFQLTGBOWFF-UHFFFAOYSA-N
XLogP1.84
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine?
The IUPAC name of 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine (CID 23027628) is 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine?
The canonical SMILES for 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine is Cc1nc(NC2CCC(N)CC2)nc(N(C)C)c1C.
What is the InChIKey of 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine?
The InChIKey is BQROFQLTGBOWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-9-10(2)16-14(18-13(9)19(3)4)17-12-7-5-11(15)6-8-12/h11-12H,5-8,15H2,1-4H3,(H,16,17,18).
What are the key properties of 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine?
2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine has a molecular weight of 263.39 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-aminocyclohexyl)-4-N,4-N,5,6-tetramethylpyrimidine-2,4-diamine is sourced from PubChem (CID 23027628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).