2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine

C16H19N3O — CID 104611662

IUPAC2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine
SMILESCOC1(c2nc(N)cc(-c3ccccc3)n2)CCCC1
InChIInChI=1S/C16H19N3O/c1-20-16(9-5-6-10-16)15-18-13(11-14(17)19-15)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3,(H2,17,18,19)
InChIKeyCYUBBLZGRBYLCJ-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.14
Rot. Bonds3

About 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine

2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine (PubChem CID 104611662) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine
PubChem CID104611662
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine
SMILESCOC1(c2nc(N)cc(-c3ccccc3)n2)CCCC1
InChIInChI=1S/C16H19N3O/c1-20-16(9-5-6-10-16)15-18-13(11-14(17)19-15)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3,(H2,17,18,19)
InChIKeyCYUBBLZGRBYLCJ-UHFFFAOYSA-N
XLogP3.14
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine
CID 104611798
[2-(1-methoxycyclobutyl)-6-phenylpyrimidin-4-yl]hydrazine
CID 116730279
2-(1-methoxycycloheptyl)-6-propan-2-ylpyrimidin-4-amine
CID 116775665
2-methoxy-6-phenylpyrimidin-4-amine
CID 83848071
2-(1-methoxy-4,4-dimethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
CID 116775657
4,6-dichloro-5-(3-chlorophenyl)-2-(1-methoxycyclobutyl)pyrimidine
CID 116706634
4-methoxy-6-phenylpyrimidin-2-amine
CID 676910
6-tert-butyl-2-(1-methoxy-4,4-dimethylcyclohexyl)pyrimidin-4-amine
CID 116775622
6-[3-(1-methoxycyclobutyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 116701531
2-(1-methoxy-4,4-dimethylcyclohexyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 116776150
4-[3-(1-methoxycyclopentyl)-1,2,4-oxadiazol-5-yl]aniline
CID 104609706
[2-(1-methoxycyclohexyl)-6-methylpyrimidin-4-yl]methanamine
CID 116778602

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine?
The IUPAC name of 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine (CID 104611662) is 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine is COC1(c2nc(N)cc(-c3ccccc3)n2)CCCC1.
What is the InChIKey of 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine?
The InChIKey is CYUBBLZGRBYLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-20-16(9-5-6-10-16)15-18-13(11-14(17)19-15)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3,(H2,17,18,19).
What are the key properties of 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine?
2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine has a molecular weight of 269.35 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-amine is sourced from PubChem (CID 104611662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).