2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine

C14H17FN4 — CID 79718495

IUPAC2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine
SMILESCNCCc1c(C)nc(-c2ccc(F)cn2)nc1C
InChIInChI=1S/C14H17FN4/c1-9-12(6-7-16-3)10(2)19-14(18-9)13-5-4-11(15)8-17-13/h4-5,8,16H,6-7H2,1-3H3
InChIKeyFTODOLLECGXVCE-UHFFFAOYSA-N
MW260.32 g/mol
LogP2.06
Rot. Bonds4

About 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine

2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine (PubChem CID 79718495) has the molecular formula C14H17FN4 and a molecular weight of 260.32 g/mol. Its IUPAC name is 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine.

Molecular Properties

Compound Name2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine
PubChem CID79718495
Molecular FormulaC14H17FN4
Molecular Weight260.32 g/mol
Exact Mass260.14
IUPAC Name2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine
SMILESCNCCc1c(C)nc(-c2ccc(F)cn2)nc1C
InChIInChI=1S/C14H17FN4/c1-9-12(6-7-16-3)10(2)19-14(18-9)13-5-4-11(15)8-17-13/h4-5,8,16H,6-7H2,1-3H3
InChIKeyFTODOLLECGXVCE-UHFFFAOYSA-N
XLogP2.06
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Amprolium Hydrochloride
CID 8732
Amprolium
CID 73341
SB-220025
CID 5164
2-Amino-4-phenylpyrimidine
CID 598777
Amprolium ion
CID 2178
VK-19911
CID 9797240
SB-242235
CID 9863367
2-isopropyl-7-(3-(trifluoromethyl)pyridin-2-yl)-N-(5-(trifluoromethyl)pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[5,4-d]azepin-4-amine
CID 52949700
6-N-methyl-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine
CID 5328376
Pik-iii
CID 67983123
5-Chloro-6-methyl-N-(2-phenylethyl)-2-pyridin-2-ylpyrimidin-4-amine
CID 2740174
2,4-Diamino-6-(2-pyridyl)-1,3,5-triazine
CID 212817

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine?
The IUPAC name of 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine (CID 79718495) is 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine.
What is the SMILES notation for 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine?
The canonical SMILES for 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine is CNCCc1c(C)nc(-c2ccc(F)cn2)nc1C.
What is the InChIKey of 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine?
The InChIKey is FTODOLLECGXVCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4/c1-9-12(6-7-16-3)10(2)19-14(18-9)13-5-4-11(15)8-17-13/h4-5,8,16H,6-7H2,1-3H3.
What are the key properties of 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine?
2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine has a molecular weight of 260.32 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine is sourced from PubChem (CID 79718495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).