4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine

C10H18N4O — CID 19135683

IUPAC4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine
SMILESCC(C)Nc1ncnc(OC(C)C)c1N
InChIInChI=1S/C10H18N4O/c1-6(2)14-9-8(11)10(13-5-12-9)15-7(3)4/h5-7H,11H2,1-4H3,(H,12,13,14)
InChIKeyCQGSJTYMKGAMHO-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.67
Rot. Bonds4

About 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine

4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine (PubChem CID 19135683) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine.

Molecular Properties

Compound Name4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine
PubChem CID19135683
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine
SMILESCC(C)Nc1ncnc(OC(C)C)c1N
InChIInChI=1S/C10H18N4O/c1-6(2)14-9-8(11)10(13-5-12-9)15-7(3)4/h5-7H,11H2,1-4H3,(H,12,13,14)
InChIKeyCQGSJTYMKGAMHO-UHFFFAOYSA-N
XLogP1.67
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine?
The IUPAC name of 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine (CID 19135683) is 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine.
What is the SMILES notation for 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine?
The canonical SMILES for 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine is CC(C)Nc1ncnc(OC(C)C)c1N.
What is the InChIKey of 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine?
The InChIKey is CQGSJTYMKGAMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-6(2)14-9-8(11)10(13-5-12-9)15-7(3)4/h5-7H,11H2,1-4H3,(H,12,13,14).
What are the key properties of 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine?
4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine has a molecular weight of 210.28 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-propan-2-yl-6-propan-2-yloxypyrimidine-4,5-diamine is sourced from PubChem (CID 19135683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).