6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine

C14H26N4 — CID 11276767

IUPAC6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine
SMILESCCCCc1cc(NCCC)nc(NCCC)n1
InChIInChI=1S/C14H26N4/c1-4-7-8-12-11-13(15-9-5-2)18-14(17-12)16-10-6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18)
InChIKeyUYWCDBMUBBSZOJ-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.46
Rot. Bonds9

About 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine

6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine (PubChem CID 11276767) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine
PubChem CID11276767
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine
SMILESCCCCc1cc(NCCC)nc(NCCC)n1
InChIInChI=1S/C14H26N4/c1-4-7-8-12-11-13(15-9-5-2)18-14(17-12)16-10-6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18)
InChIKeyUYWCDBMUBBSZOJ-UHFFFAOYSA-N
XLogP3.46
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine?
The IUPAC name of 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine (CID 11276767) is 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine?
The canonical SMILES for 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine is CCCCc1cc(NCCC)nc(NCCC)n1.
What is the InChIKey of 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine?
The InChIKey is UYWCDBMUBBSZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-4-7-8-12-11-13(15-9-5-2)18-14(17-12)16-10-6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine?
6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine has a molecular weight of 250.39 g/mol, XLogP of 3.46, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butyl-2-N,4-N-dipropylpyrimidine-2,4-diamine is sourced from PubChem (CID 11276767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).