4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine

C14H26N4 — CID 112924207

IUPAC4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine
SMILESCCCCN(C)c1cc(C)nc(N(CC)CC)n1
InChIInChI=1S/C14H26N4/c1-6-9-10-17(5)13-11-12(4)15-14(16-13)18(7-2)8-3/h11H,6-10H2,1-5H3
InChIKeyZJXNCLCKVQHRAY-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.87
Rot. Bonds7

About 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine

4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine (PubChem CID 112924207) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine
PubChem CID112924207
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine
SMILESCCCCN(C)c1cc(C)nc(N(CC)CC)n1
InChIInChI=1S/C14H26N4/c1-6-9-10-17(5)13-11-12(4)15-14(16-13)18(7-2)8-3/h11H,6-10H2,1-5H3
InChIKeyZJXNCLCKVQHRAY-UHFFFAOYSA-N
XLogP2.87
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine with MolForge

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Related Compounds

4-N-benzyl-2-N-butyl-4-N-ethyl-2-N,6-dimethylpyrimidine-2,4-diamine
CID 112918901
N-butyl-6-chloro-N,2-dimethylpyrimidin-4-amine
CID 62483143
4-N-butyl-6-chloro-2-N,2-N-diethyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 62870530
3-N-butyl-5-N,5-N-diethyl-3-N-methyl-1,2,4-triazine-3,5-diamine
CID 112958192
4-N-butyl-4-N,2-dimethylpyrimidine-4,6-diamine
CID 80753579
4-N-benzyl-2-N-butyl-2-N,6-dimethyl-4-N-propan-2-ylpyrimidine-2,4-diamine
CID 112925035
N-butyl-N,6-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 59340680
N-butyl-N,6-dimethyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine
CID 112925677
4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80916617
N-butyl-2-[4-(4-methoxyphenyl)piperazin-1-yl]-N,6-dimethylpyrimidin-4-amine
CID 112925591
2-[(4,6-dimethylpyrimidin-2-yl)-ethylamino]ethanol
CID 61147655
4-N-butyl-4-N-methylpyrimidine-2,4,6-triamine
CID 78982418

Frequently Asked Questions

What is the IUPAC name of 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine (CID 112924207) is 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine is CCCCN(C)c1cc(C)nc(N(CC)CC)n1.
What is the InChIKey of 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
The InChIKey is ZJXNCLCKVQHRAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-6-9-10-17(5)13-11-12(4)15-14(16-13)18(7-2)8-3/h11H,6-10H2,1-5H3.
What are the key properties of 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.87, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-butyl-2-N,2-N-diethyl-4-N,6-dimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 112924207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).