N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine

C11H16FN3 — CID 115417181

IUPACN-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine
SMILESCC1(C)CCCC1Nc1cc(F)ncn1
InChIInChI=1S/C11H16FN3/c1-11(2)5-3-4-8(11)15-10-6-9(12)13-7-14-10/h6-8H,3-5H2,1-2H3,(H,13,14,15)
InChIKeyIBNQAYHFQFWCRE-UHFFFAOYSA-N
MW209.27 g/mol
LogP2.61
Rot. Bonds2

About N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine

N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine (PubChem CID 115417181) has the molecular formula C11H16FN3 and a molecular weight of 209.27 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine
PubChem CID115417181
Molecular FormulaC11H16FN3
Molecular Weight209.27 g/mol
Exact Mass209.13
IUPAC NameN-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine
SMILESCC1(C)CCCC1Nc1cc(F)ncn1
InChIInChI=1S/C11H16FN3/c1-11(2)5-3-4-8(11)15-10-6-9(12)13-7-14-10/h6-8H,3-5H2,1-2H3,(H,13,14,15)
InChIKeyIBNQAYHFQFWCRE-UHFFFAOYSA-N
XLogP2.61
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-dimethylcyclopropyl)-6-fluoropyrimidin-4-amine
CID 115416834
4-N-(2,2-dimethylcyclohexyl)pyrimidine-4,6-diamine
CID 80849471
N-(2,2-dimethylcyclohexyl)-6-hydrazinylpyrimidin-4-amine
CID 80929966
5-amino-2-[(2,2-dimethylcyclopentyl)amino]pyridine-4-carboxamide
CID 114090460
N-(2,2-dimethylcyclopentyl)-3-methylpyrazin-2-amine
CID 83064774
N-(2,2-dimethylcyclopentyl)-1,5-dimethylpyrazol-3-amine
CID 115921991
N-(2,2-dimethylcyclopentyl)-2-methylpyrimidin-4-amine
CID 79838962
2-N-(2,2-dimethylcyclopentyl)quinoline-2,6-diamine
CID 79861402
2-chloro-N-(2,2-dimethylcyclopentyl)-5-fluoroaniline
CID 107527334
N-(1-cyclopropylcyclopropyl)-6-fluoropyrimidin-4-amine
CID 164653559
6-fluoro-N-[1-(1-methylcyclopropyl)cyclopropyl]pyrimidin-4-amine
CID 130959924
4-[(6-fluoropyrimidin-4-yl)amino]cyclohexan-1-ol
CID 104966807

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine?
The IUPAC name of N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine (CID 115417181) is N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine.
What is the SMILES notation for N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine?
The canonical SMILES for N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine is CC1(C)CCCC1Nc1cc(F)ncn1.
What is the InChIKey of N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine?
The InChIKey is IBNQAYHFQFWCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3/c1-11(2)5-3-4-8(11)15-10-6-9(12)13-7-14-10/h6-8H,3-5H2,1-2H3,(H,13,14,15).
What are the key properties of N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine?
N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine has a molecular weight of 209.27 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopentyl)-6-fluoropyrimidin-4-amine is sourced from PubChem (CID 115417181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).