2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine

C15H25N3O — CID 104611698

IUPAC2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2(OC)CCCC2)nc(C)c1C
InChIInChI=1S/C15H25N3O/c1-5-10-16-13-11(2)12(3)17-14(18-13)15(19-4)8-6-7-9-15/h5-10H2,1-4H3,(H,16,17,18)
InChIKeyAGDOIPCVVWDWDE-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.33
Rot. Bonds5

About 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine

2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine (PubChem CID 104611698) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
PubChem CID104611698
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(C2(OC)CCCC2)nc(C)c1C
InChIInChI=1S/C15H25N3O/c1-5-10-16-13-11(2)12(3)17-14(18-13)15(19-4)8-6-7-9-15/h5-10H2,1-4H3,(H,16,17,18)
InChIKeyAGDOIPCVVWDWDE-UHFFFAOYSA-N
XLogP3.33
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 ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethyl-2-(1-methoxycyclohexyl)-5-methyl-N-propylpyrimidin-4-amine
CID 116776378
5-bromo-2-(1-methoxycycloheptyl)-6-methyl-N-propylpyrimidin-4-amine
CID 116776525
2-(1-methoxycycloheptyl)-N,5,6-trimethylpyrimidin-4-amine
CID 116776105
6-ethyl-5-iodo-2-(1-methoxycyclopentyl)-N-propylpyrimidin-4-amine
CID 104611744
N-[[2-(1-methoxycyclopentyl)-4,6-dimethylpyrimidin-5-yl]methyl]propan-1-amine
CID 104611901
2-(1-methoxycyclopentyl)-N-propyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 104611784
5-bromo-2-(1-methoxycyclopentyl)-N-propylpyrimidin-4-amine
CID 104611761
N-ethyl-5-fluoro-2-(1-methoxycyclohexyl)-6-methylpyrimidin-4-amine
CID 116776421
2-(1-ethoxycyclohexyl)-5-fluoro-6-methyl-N-propylpyrimidin-4-amine
CID 116776442
N-[2-[2-(1-methoxycyclobutyl)-4,6-dimethylpyrimidin-5-yl]ethyl]propan-1-amine
CID 116731669
N-[[2-(1-methoxycyclopentyl)-4,6-dimethylpyrimidin-5-yl]methyl]ethanamine
CID 104611900
N-ethyl-2-[2-(1-methoxycyclobutyl)-4,6-dimethylpyrimidin-5-yl]ethanamine
CID 116731657

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine (CID 104611698) is 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine is CCCNc1nc(C2(OC)CCCC2)nc(C)c1C.
What is the InChIKey of 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
The InChIKey is AGDOIPCVVWDWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-10-16-13-11(2)12(3)17-14(18-13)15(19-4)8-6-7-9-15/h5-10H2,1-4H3,(H,16,17,18).
What are the key properties of 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine has a molecular weight of 263.38 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclopentyl)-5,6-dimethyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 104611698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).