N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine

C15H25N3O — CID 66324640

IUPACN-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
SMILESCCC1CCC(CNc2cc(OC)nc(C)n2)CC1
InChIInChI=1S/C15H25N3O/c1-4-12-5-7-13(8-6-12)10-16-14-9-15(19-3)18-11(2)17-14/h9,12-13H,4-8,10H2,1-3H3,(H,16,17,18)
InChIKeyJITQEKGXAAFVEV-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.42
Rot. Bonds5

About N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine

N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine (PubChem CID 66324640) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
PubChem CID66324640
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
SMILESCCC1CCC(CNc2cc(OC)nc(C)n2)CC1
InChIInChI=1S/C15H25N3O/c1-4-12-5-7-13(8-6-12)10-16-14-9-15(19-3)18-11(2)17-14/h9,12-13H,4-8,10H2,1-3H3,(H,16,17,18)
InChIKeyJITQEKGXAAFVEV-UHFFFAOYSA-N
XLogP3.42
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-aminocyclopentyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 106126705
3-[[(6-methoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 66326326
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66324847
N-(cyclobutylmethyl)-6-ethoxy-2-methylpyrimidin-4-amine
CID 66326683
2-[[(6-methoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 66326314
N-(cyclopropylmethyl)-2,6-dimethylpyrimidin-4-amine
CID 60732015
N-(cyclopropylmethyl)-2-methyl-6-(trifluoromethyl)pyrimidin-4-amine
CID 171993956
2-[(6-methoxy-2-methylpyrimidin-4-yl)amino]ethanol
CID 66325251
N-(2-ethoxy-2-methylpropyl)-6-methoxy-2-methylpyrimidin-4-amine
CID 114942912
6-methoxy-2-methyl-N-octylpyrimidin-4-amine
CID 113337456
6-methoxy-N-(6-methoxy-2-methylpyrimidin-4-yl)-2-methylpyrimidin-4-amine
CID 121013131
4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106130133

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine?
The IUPAC name of N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine (CID 66324640) is N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine.
What is the SMILES notation for N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine?
The canonical SMILES for N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine is CCC1CCC(CNc2cc(OC)nc(C)n2)CC1.
What is the InChIKey of N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine?
The InChIKey is JITQEKGXAAFVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-12-5-7-13(8-6-12)10-16-14-9-15(19-3)18-11(2)17-14/h9,12-13H,4-8,10H2,1-3H3,(H,16,17,18).
What are the key properties of N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine?
N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine has a molecular weight of 263.38 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine is sourced from PubChem (CID 66324640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).