2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine

C15H25N3O — CID 116775977

IUPAC2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(C(C)C)nc(C2(OC)CCCCC2)n1
InChIInChI=1S/C15H25N3O/c1-11(2)12-10-13(16-3)18-14(17-12)15(19-4)8-6-5-7-9-15/h10-11H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyQTZCIDJLRYIVCW-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.45
Rot. Bonds4

About 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine

2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine (PubChem CID 116775977) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
PubChem CID116775977
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(C(C)C)nc(C2(OC)CCCCC2)n1
InChIInChI=1S/C15H25N3O/c1-11(2)12-10-13(16-3)18-14(17-12)15(19-4)8-6-5-7-9-15/h10-11H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyQTZCIDJLRYIVCW-UHFFFAOYSA-N
XLogP3.45
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 104611688
4-chloro-2-(1-methoxycyclohexyl)-6-propan-2-ylpyrimidine
CID 116745751
2-(1-methoxycycloheptyl)-6-propan-2-ylpyrimidin-4-amine
CID 116775665
6-cyclopentyl-2-(1-methoxycyclopentyl)-N-methylpyrimidin-4-amine
CID 104611786
2-(1-methoxy-4,4-dimethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
CID 116775657
4-chloro-2-(1-methoxy-4,4-dimethylcyclohexyl)-6-propan-2-ylpyrimidine
CID 116745744
[2-(1-methoxycyclopentyl)-6-(2-methylpropyl)pyrimidin-4-yl]hydrazine
CID 113432905
2-(1-ethoxycycloheptyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 116776166
2-(1-methoxycycloheptyl)-N,5,6-trimethylpyrimidin-4-amine
CID 116776105
[2-(2-methyloxan-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80681493
[1-[[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]cyclohexyl]methanol
CID 80957385
N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 62192524

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine (CID 116775977) is 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine is CNc1cc(C(C)C)nc(C2(OC)CCCCC2)n1.
What is the InChIKey of 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is QTZCIDJLRYIVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)12-10-13(16-3)18-14(17-12)15(19-4)8-6-5-7-9-15/h10-11H,5-9H2,1-4H3,(H,16,17,18).
What are the key properties of 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 263.38 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 116775977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).