6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine

C10H14FN3O — CID 115416622

IUPAC6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
SMILESCN(CC1CCCO1)c1cc(F)ncn1
InChIInChI=1S/C10H14FN3O/c1-14(6-8-3-2-4-15-8)10-5-9(11)12-7-13-10/h5,7-8H,2-4,6H2,1H3
InChIKeyNIBFSNBNKUWZJQ-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.23
Rot. Bonds3

About 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine

6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine (PubChem CID 115416622) has the molecular formula C10H14FN3O and a molecular weight of 211.24 g/mol. Its IUPAC name is 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
PubChem CID115416622
Molecular FormulaC10H14FN3O
Molecular Weight211.24 g/mol
Exact Mass211.11
IUPAC Name6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
SMILESCN(CC1CCCO1)c1cc(F)ncn1
InChIInChI=1S/C10H14FN3O/c1-14(6-8-3-2-4-15-8)10-5-9(11)12-7-13-10/h5,7-8H,2-4,6H2,1H3
InChIKeyNIBFSNBNKUWZJQ-UHFFFAOYSA-N
XLogP1.23
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-2,6-difluoro-N-methyl-N-(oxolan-2-ylmethyl)aniline
CID 63077663
[5-[methyl(oxolan-2-ylmethyl)amino]pyrazin-2-yl]methanol
CID 107372756
4-N,6-dimethyl-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 78928250
6-fluoro-N-methyl-N-(oxan-2-ylmethyl)quinazolin-4-amine
CID 133271712
5-chloro-N-methyl-N-(oxolan-2-ylmethyl)-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 114925937
4-N-ethyl-6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
CID 80798901
5-[(cyclopropylamino)methyl]-N-methyl-N-(oxolan-2-ylmethyl)pyrazin-2-amine
CID 107379575
6-chloro-N-methyl-N-(oxolan-2-ylmethyl)-5-propan-2-ylpyrimidin-4-amine
CID 63728796
N-(1,4-dioxan-2-ylmethyl)-N-methyl-6-(trifluoromethyl)pyrimidin-4-amine
CID 155973970
4-fluoro-1-N-methyl-1-N-(oxolan-2-ylmethyl)benzene-1,2-diamine
CID 61431331
N-cyclopropyl-6-fluoro-N-methylpyrimidin-4-amine
CID 115416474
5-ethyl-4-N,6-N-dimethyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
CID 80796623

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine (CID 115416622) is 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine is CN(CC1CCCO1)c1cc(F)ncn1.
What is the InChIKey of 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is NIBFSNBNKUWZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O/c1-14(6-8-3-2-4-15-8)10-5-9(11)12-7-13-10/h5,7-8H,2-4,6H2,1H3.
What are the key properties of 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine?
6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 211.24 g/mol, XLogP of 1.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 115416622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).