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

C14H23N3O — CID 104611688

IUPAC2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(C(C)C)nc(C2(OC)CCCC2)n1
InChIInChI=1S/C14H23N3O/c1-10(2)11-9-12(15-3)17-13(16-11)14(18-4)7-5-6-8-14/h9-10H,5-8H2,1-4H3,(H,15,16,17)
InChIKeyYDPGXVRCFQJYNX-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.06
Rot. Bonds4

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

2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine (PubChem CID 104611688) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
PubChem CID104611688
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
SMILESCNc1cc(C(C)C)nc(C2(OC)CCCC2)n1
InChIInChI=1S/C14H23N3O/c1-10(2)11-9-12(15-3)17-13(16-11)14(18-4)7-5-6-8-14/h9-10H,5-8H2,1-4H3,(H,15,16,17)
InChIKeyYDPGXVRCFQJYNX-UHFFFAOYSA-N
XLogP3.06
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methoxycyclohexyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 116775977
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
N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 62192524
2-(1-methoxycycloheptyl)-N,5,6-trimethylpyrimidin-4-amine
CID 116776105
[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine
CID 104611798
[2-(2-methyloxan-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80681493

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine (CID 104611688) is 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine is CNc1cc(C(C)C)nc(C2(OC)CCCC2)n1.
What is the InChIKey of 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is YDPGXVRCFQJYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-10(2)11-9-12(15-3)17-13(16-11)14(18-4)7-5-6-8-14/h9-10H,5-8H2,1-4H3,(H,15,16,17).
What are the key properties of 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine?
2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclopentyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 104611688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).