N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine

C13H21N3O — CID 66326722

IUPACN-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine
SMILESCC(C)Oc1cc(NC2CCCCC2)ncn1
InChIInChI=1S/C13H21N3O/c1-10(2)17-13-8-12(14-9-15-13)16-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,14,15,16)
InChIKeyWCGBNWPOFOFUKM-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.01
Rot. Bonds4

About N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine

N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine (PubChem CID 66326722) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine
PubChem CID66326722
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine
SMILESCC(C)Oc1cc(NC2CCCCC2)ncn1
InChIInChI=1S/C13H21N3O/c1-10(2)17-13-8-12(14-9-15-13)16-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,14,15,16)
InChIKeyWCGBNWPOFOFUKM-UHFFFAOYSA-N
XLogP3.01
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorocycloheptyl)-6-propan-2-yloxypyrimidin-4-amine
CID 113395027
N-(1-methylpyrrolidin-3-yl)-6-propan-2-yloxypyrimidin-4-amine
CID 66330565
N-(3,3-dimethylcyclopentyl)-6-propan-2-yloxypyrimidin-4-amine
CID 114547927
N-(2,2-dimethyloxan-4-yl)-6-propan-2-yloxypyrimidin-4-amine
CID 83029026
6-butoxy-N-cyclohexylpyrimidin-4-amine
CID 82453632
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
N-(6-propan-2-yloxypyrimidin-4-yl)-3-azabicyclo[3.1.0]hexan-6-amine
CID 66331604
N-(1-cyclopropylpropan-2-yl)-6-propan-2-yloxypyrimidin-4-amine
CID 66330794
6-(cycloheptylamino)-N-(4-propan-2-yloxyphenyl)pyrimidine-4-carboxamide
CID 109354003
4-N-cyclohexyl-6-N-(3-methylbutyl)pyrimidine-4,6-diamine
CID 112856250
N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-6-propan-2-yloxypyrimidin-4-amine
CID 66329616
N'-propan-2-yl-N-(6-propan-2-yloxypyrimidin-4-yl)ethane-1,2-diamine
CID 66334042

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine?
The IUPAC name of N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine (CID 66326722) is N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine.
What is the SMILES notation for N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine?
The canonical SMILES for N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine is CC(C)Oc1cc(NC2CCCCC2)ncn1.
What is the InChIKey of N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine?
The InChIKey is WCGBNWPOFOFUKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10(2)17-13-8-12(14-9-15-13)16-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,14,15,16).
What are the key properties of N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine?
N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine is sourced from PubChem (CID 66326722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).