5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine

C10H15FN4O — CID 124594370

IUPAC5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine
SMILESCN1CCO[C@@H](CNc2ncc(F)cn2)C1
InChIInChI=1S/C10H15FN4O/c1-15-2-3-16-9(7-15)6-14-10-12-4-8(11)5-13-10/h4-5,9H,2-3,6-7H2,1H3,(H,12,13,14)/t9-/m0/s1
InChIKeyIBLJVXPDOZRJMA-VIFPVBQESA-N
MW226.25 g/mol
LogP0.36
Rot. Bonds3

About 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine

5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine (PubChem CID 124594370) has the molecular formula C10H15FN4O and a molecular weight of 226.25 g/mol. Its IUPAC name is 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine
PubChem CID124594370
Molecular FormulaC10H15FN4O
Molecular Weight226.25 g/mol
Exact Mass226.12
IUPAC Name5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine
SMILESCN1CCO[C@@H](CNc2ncc(F)cn2)C1
InChIInChI=1S/C10H15FN4O/c1-15-2-3-16-9(7-15)6-14-10-12-4-8(11)5-13-10/h4-5,9H,2-3,6-7H2,1H3,(H,12,13,14)/t9-/m0/s1
InChIKeyIBLJVXPDOZRJMA-VIFPVBQESA-N
XLogP0.36
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(2R)-2-[[(5-fluoropyrimidin-2-yl)amino]methyl]morpholin-4-yl]ethanone
CID 125440889
3,5-difluoro-N-[(4-methylmorpholin-2-yl)methyl]aniline
CID 79171790
4,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
CID 78952498
N-[[(2R)-4-methylmorpholin-2-yl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 95160947
N-[(4-methylmorpholin-2-yl)methyl]-1,2,4-benzotriazin-3-amine
CID 103204381
3-N-[(4-methylmorpholin-2-yl)methyl]-1H-1,2,4-triazole-3,5-diamine
CID 79071706
N-[(4-ethylmorpholin-2-yl)methyl]-5-iodopyrimidin-2-amine
CID 113459925
2-bromo-4,6-difluoro-N-[(4-methylmorpholin-2-yl)methyl]aniline
CID 79172288
5-[(4-methylmorpholin-2-yl)methylamino]pyridine-2-carboxylic acid
CID 115490999
6-N-methyl-4-N-[(4-methylmorpholin-2-yl)methyl]pyrimidine-4,6-diamine
CID 80850810
4-ethoxy-6-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-2-amine
CID 112638139
5-[(4-methylmorpholin-2-yl)methylamino]pyrazine-2-carboxylic acid
CID 79070897

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine?
The IUPAC name of 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine (CID 124594370) is 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine.
What is the SMILES notation for 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine?
The canonical SMILES for 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine is CN1CCO[C@@H](CNc2ncc(F)cn2)C1.
What is the InChIKey of 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine?
The InChIKey is IBLJVXPDOZRJMA-VIFPVBQESA-N. The full InChI is InChI=1S/C10H15FN4O/c1-15-2-3-16-9(7-15)6-14-10-12-4-8(11)5-13-10/h4-5,9H,2-3,6-7H2,1H3,(H,12,13,14)/t9-/m0/s1.
What are the key properties of 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine?
5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine has a molecular weight of 226.25 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine is sourced from PubChem (CID 124594370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).