4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine

C10H16N4 — CID 80827503

IUPAC4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine
SMILESCCc1c(N)ncnc1NC1CCC1
InChIInChI=1S/C10H16N4/c1-2-8-9(11)12-6-13-10(8)14-7-4-3-5-7/h6-7H,2-5H2,1H3,(H3,11,12,13,14)
InChIKeyWSLXDBOLQKVTAI-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.59
Rot. Bonds3

About 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine

4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine (PubChem CID 80827503) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine
PubChem CID80827503
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine
SMILESCCc1c(N)ncnc1NC1CCC1
InChIInChI=1S/C10H16N4/c1-2-8-9(11)12-6-13-10(8)14-7-4-3-5-7/h6-7H,2-5H2,1H3,(H3,11,12,13,14)
InChIKeyWSLXDBOLQKVTAI-UHFFFAOYSA-N
XLogP1.59
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-4-N-(4-propylcyclohexyl)pyrimidine-4,6-diamine
CID 80807733
4-N-(3,3-dimethylcyclopentyl)-5-ethylpyrimidine-4,6-diamine
CID 114542173
N-cyclopropyl-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80932555
4-N-cyclopentyl-6-N,5-diethylpyrimidine-4,6-diamine
CID 80770074
5-ethyl-4-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-4,6-diamine
CID 80822032
4-N-(2,3-dimethylcyclopentyl)-5-ethylpyrimidine-4,6-diamine
CID 80840241
4-[(6-amino-5-ethylpyrimidin-4-yl)amino]pyrrolidin-2-one
CID 106198309
5-ethyl-4-N-methylpyrimidine-4,6-diamine
CID 80770928
6-chloro-N-cyclopropyl-5-ethylpyrimidin-4-amine
CID 63734410
4-N-[2-[cyclopentyl(methyl)amino]ethyl]-5-ethylpyrimidine-4,6-diamine
CID 80829852
5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 80944076
5-ethyl-4-N-[2-(3-methylcyclohexyl)ethyl]pyrimidine-4,6-diamine
CID 80835454

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine (CID 80827503) is 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine is CCc1c(N)ncnc1NC1CCC1.
What is the InChIKey of 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine?
The InChIKey is WSLXDBOLQKVTAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-2-8-9(11)12-6-13-10(8)14-7-4-3-5-7/h6-7H,2-5H2,1H3,(H3,11,12,13,14).
What are the key properties of 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine?
4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine has a molecular weight of 192.27 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine is sourced from PubChem (CID 80827503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).