6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine

C17H27N3O — CID 104611787

IUPAC6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine
SMILESCCNc1cc(C2CCCC2)nc(C2(OC)CCCC2)n1
InChIInChI=1S/C17H27N3O/c1-3-18-15-12-14(13-8-4-5-9-13)19-16(20-15)17(21-2)10-6-7-11-17/h12-13H,3-11H2,1-2H3,(H,18,19,20)
InChIKeyBQZLYWDSDGBECZ-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.98
Rot. Bonds5

About 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine

6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine (PubChem CID 104611787) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine
PubChem CID104611787
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine
SMILESCCNc1cc(C2CCCC2)nc(C2(OC)CCCC2)n1
InChIInChI=1S/C17H27N3O/c1-3-18-15-12-14(13-8-4-5-9-13)19-16(20-15)17(21-2)10-6-7-11-17/h12-13H,3-11H2,1-2H3,(H,18,19,20)
InChIKeyBQZLYWDSDGBECZ-UHFFFAOYSA-N
XLogP3.98
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyclopentyl-2-(1-methoxycyclopentyl)-N-methylpyrimidin-4-amine
CID 104611786
4-chloro-6-cyclopropyl-2-(1-methoxycyclopentyl)pyrimidine
CID 104609956
4-chloro-6-cyclopropyl-2-(1-methoxycyclobutyl)pyrimidine
CID 116706276
4-chloro-6-cyclopentyl-2-(1-methoxy-4-methylcyclohexyl)pyrimidine
CID 116746448
6-cyclopentyl-N-ethyl-2-(ethylsulfanylmethyl)pyrimidin-4-amine
CID 113390479
4-chloro-6-cyclopentyl-2-(4-methoxyoxan-4-yl)pyrimidine
CID 116746454
2-(4-bromo-5-methylthiophen-2-yl)-6-cyclopentyl-N-ethylpyrimidin-4-amine
CID 102844138
6-cyclopropyl-N-ethyl-2-(oxolan-2-ylmethyl)pyrimidin-4-amine
CID 55188916
4-chloro-6-cyclopropyl-2-(1-methoxy-3-methylcyclohexyl)pyrimidine
CID 116745914
4,6-dichloro-5-cyclopentyl-2-(1-methoxycyclohexyl)pyrimidine
CID 116746440
6-cyclopropyl-2-(1-ethoxycycloheptyl)pyrimidin-4-amine
CID 116776273
4-cyclopentyl-2-(1-methoxycyclohexyl)-1H-pyrimidin-6-one
CID 136964163

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine?
The IUPAC name of 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine (CID 104611787) is 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine?
The canonical SMILES for 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine is CCNc1cc(C2CCCC2)nc(C2(OC)CCCC2)n1.
What is the InChIKey of 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine?
The InChIKey is BQZLYWDSDGBECZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-3-18-15-12-14(13-8-4-5-9-13)19-16(20-15)17(21-2)10-6-7-11-17/h12-13H,3-11H2,1-2H3,(H,18,19,20).
What are the key properties of 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine?
6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine has a molecular weight of 289.42 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-N-ethyl-2-(1-methoxycyclopentyl)pyrimidin-4-amine is sourced from PubChem (CID 104611787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).