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

C10H18N4 — CID 22613295

IUPAC4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine
SMILESCCN(CC)c1cc(N(C)C)ncn1
InChIInChI=1S/C10H18N4/c1-5-14(6-2)10-7-9(13(3)4)11-8-12-10/h7-8H,5-6H2,1-4H3
InChIKeyAFRSVVWQSIXQLF-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.39
Rot. Bonds4

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

4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine (PubChem CID 22613295) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine
PubChem CID22613295
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine
SMILESCCN(CC)c1cc(N(C)C)ncn1
InChIInChI=1S/C10H18N4/c1-5-14(6-2)10-7-9(13(3)4)11-8-12-10/h7-8H,5-6H2,1-4H3
InChIKeyAFRSVVWQSIXQLF-UHFFFAOYSA-N
XLogP1.39
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methylpyrimidin-4-amine
CID 295763
2-Chloro-N,N-dimethylpyrimidin-4-amine
CID 95975
6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine
CID 1484287
Pyrimidine-4,6-diamine
CID 79608
6-(4-Methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 753256
N4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 25129179
4-Chloro-6-(pyrrolidin-1-yl)pyrimidine
CID 22309524
2-Methylpyrimidine
CID 78748
N,N-Dimethylpyrimidin-4-amine
CID 579196
6-chloro-N,N-dimethylpyrimidin-4-amine
CID 13869568
4,6-Pyrimidinediamine, monohydrochloride
CID 79607
4-N-methyl-6-pyrrolidin-1-ylpyrimidine-2,4-diamine
CID 21749035

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine?
The IUPAC name of 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine (CID 22613295) is 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine is CCN(CC)c1cc(N(C)C)ncn1.
What is the InChIKey of 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine?
The InChIKey is AFRSVVWQSIXQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-5-14(6-2)10-7-9(13(3)4)11-8-12-10/h7-8H,5-6H2,1-4H3.
What are the key properties of 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine?
4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine has a molecular weight of 194.28 g/mol, XLogP of 1.39, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine is sourced from PubChem (CID 22613295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).