N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine

C11H16FN3O — CID 14717234

IUPACN-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine
SMILESCOc1cc(F)nc(NC2CCCCC2)n1
InChIInChI=1S/C11H16FN3O/c1-16-10-7-9(12)14-11(15-10)13-8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,13,14,15)
InChIKeyCZUYFAHEVDWEDU-UHFFFAOYSA-N
MW225.27 g/mol
LogP2.37
Rot. Bonds3

About N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine

N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine (PubChem CID 14717234) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine
PubChem CID14717234
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC NameN-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine
SMILESCOc1cc(F)nc(NC2CCCCC2)n1
InChIInChI=1S/C11H16FN3O/c1-16-10-7-9(12)14-11(15-10)13-8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,13,14,15)
InChIKeyCZUYFAHEVDWEDU-UHFFFAOYSA-N
XLogP2.37
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-butyl-6-methoxypyrimidine-2,4-diamine
CID 103817396
4-methoxy-N-(piperidin-4-yl)pyrimidin-2-amine
CID 43607806
6-methoxy-N-[2-[(2R)-1-methylpyrrolidin-2-yl]ethyl]pyrimidin-4-amine
CID 39818605
N-cyclohexyl-4-methoxy-N-methylpyrimidin-2-amine
CID 75413295
N-cycloheptyl-4-methoxypyrimidin-2-amine
CID 112683365
N-(3,3-difluorocyclobutyl)-4,6-dimethoxypyrimidin-2-amine
CID 136542373
6-methoxy-4-N-[(3S)-1-propylpyrrolidin-3-yl]pyrimidine-2,4-diamine
CID 164638135
N-[[(2R)-1-ethylpiperidin-2-yl]methyl]-4,6-dimethoxypyrimidin-2-amine
CID 164638252
4-N-[[(2S)-1,4-dimethylpiperazin-2-yl]methyl]-6-methoxypyrimidine-2,4-diamine
CID 164642016
4-fluoro-6-methoxy-N-methylpyrimidin-2-amine
CID 14717233
4-Fluoro-2-n-hexylamino-6-methoxypyrimidine
CID 14717235
4-fluoro-N-prop-2-enyl-6-(trifluoromethoxy)pyrimidin-2-amine
CID 21996891

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
The IUPAC name of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine (CID 14717234) is N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
The canonical SMILES for N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine is COc1cc(F)nc(NC2CCCCC2)n1.
What is the InChIKey of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
The InChIKey is CZUYFAHEVDWEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c1-16-10-7-9(12)14-11(15-10)13-8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,13,14,15).
What are the key properties of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine has a molecular weight of 225.27 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine is sourced from PubChem (CID 14717234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).