N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine

C14H23N3O — CID 82454018

IUPACN-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine
SMILESCCCOc1cc(NC2CCCCC2)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-3-9-18-14-10-13(15-11(2)16-14)17-12-7-5-4-6-8-12/h10,12H,3-9H2,1-2H3,(H,15,16,17)
InChIKeyZAFJZXIVNMDTEJ-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.32
Rot. Bonds5

About N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine

N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine (PubChem CID 82454018) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine
PubChem CID82454018
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine
SMILESCCCOc1cc(NC2CCCCC2)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-3-9-18-14-10-13(15-11(2)16-14)17-12-7-5-4-6-8-12/h10,12H,3-9H2,1-2H3,(H,15,16,17)
InChIKeyZAFJZXIVNMDTEJ-UHFFFAOYSA-N
XLogP3.32
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclohexyl-N-cyclopentyl-6-propoxypyrimidin-4-amine
CID 82458395
2-cyclohexyl-N-cyclopropyl-6-propoxypyrimidin-4-amine
CID 82458391
2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
CID 82453995
6-butoxy-N-cycloheptyl-2-ethylpyrimidin-4-amine
CID 82454357
6-butoxy-N-cyclohexyl-2-cyclopropylpyrimidin-4-amine
CID 82456524
6-ethoxy-2-methyl-N-(4-propylcyclohexyl)pyrimidin-4-amine
CID 66324652
6-N-butyl-4-N-cycloheptyl-2-methylpyrimidine-4,6-diamine
CID 112867907
2-methyl-6-propoxy-N-propylpyrimidin-4-amine
CID 80866216
6-butoxy-N-cyclopentyl-2-propan-2-ylpyrimidin-4-amine
CID 82454374
6-butoxy-N-cyclohexylpyrimidin-4-amine
CID 82453632
4-N-cyclooctyl-2-methylpyrimidine-4,6-diamine
CID 80786651
6-ethoxy-N-(2-ethylcyclohexyl)-2-methylpyrimidin-4-amine
CID 66327527

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine?
The IUPAC name of N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine (CID 82454018) is N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine.
What is the SMILES notation for N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine?
The canonical SMILES for N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine is CCCOc1cc(NC2CCCCC2)nc(C)n1.
What is the InChIKey of N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine?
The InChIKey is ZAFJZXIVNMDTEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-9-18-14-10-13(15-11(2)16-14)17-12-7-5-4-6-8-12/h10,12H,3-9H2,1-2H3,(H,15,16,17).
What are the key properties of N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine?
N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methyl-6-propoxypyrimidin-4-amine is sourced from PubChem (CID 82454018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).