N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine

C14H23N3O — CID 102634706

IUPACN-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine
SMILESCCCc1cc(OC2CCCCC2NC)ncn1
InChIInChI=1S/C14H23N3O/c1-3-6-11-9-14(17-10-16-11)18-13-8-5-4-7-12(13)15-2/h9-10,12-13,15H,3-8H2,1-2H3
InChIKeyLCMRJAAESAASQZ-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.34
Rot. Bonds5

About N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine

N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine (PubChem CID 102634706) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine
PubChem CID102634706
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine
SMILESCCCc1cc(OC2CCCCC2NC)ncn1
InChIInChI=1S/C14H23N3O/c1-3-6-11-9-14(17-10-16-11)18-13-8-5-4-7-12(13)15-2/h9-10,12-13,15H,3-8H2,1-2H3
InChIKeyLCMRJAAESAASQZ-UHFFFAOYSA-N
XLogP2.34
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 ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine
CID 102634526
N-methyl-2-(4-propylphenoxy)cyclopentan-1-amine
CID 55085230
2-[(6-methoxy-2-pyridinyl)oxy]-N-methylcyclohexan-1-amine
CID 102634392
N-(2-chloroethyl)-N-cyclopentyl-6-propylpyrimidin-4-amine
CID 63388833
N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine
CID 61241873
N-methyl-2-(6-propylpyrimidin-4-yl)oxypropan-1-amine
CID 62349056
2-(6-methoxy-5-nitropyrimidin-4-yl)oxy-N-methylcyclohexan-1-amine
CID 102634762
N-methyl-2-[(5-nitro-2-pyridinyl)oxy]cyclohexan-1-amine
CID 102634307
N-(2-cyclopentylethyl)-6-propylpyrimidin-4-amine
CID 61241874
2-methyl-1-(6-propylpyrimidin-4-yl)oxybutan-2-amine
CID 64572779
N-(2-bromoethyl)-N-cyclobutyl-6-propylpyrimidin-4-amine
CID 102871599
N-methyl-2-(1-methylimidazol-2-yl)oxycyclohexan-1-amine
CID 102634501

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine?
The IUPAC name of N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine (CID 102634706) is N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine?
The canonical SMILES for N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine is CCCc1cc(OC2CCCCC2NC)ncn1.
What is the InChIKey of N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine?
The InChIKey is LCMRJAAESAASQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-6-11-9-14(17-10-16-11)18-13-8-5-4-7-12(13)15-2/h9-10,12-13,15H,3-8H2,1-2H3.
What are the key properties of N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine?
N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine has a molecular weight of 249.36 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(6-propylpyrimidin-4-yl)oxycyclohexan-1-amine is sourced from PubChem (CID 102634706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).