4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine

C14H16F3N5O — CID 129329079

IUPAC4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine
SMILESCOc1ccnc(NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)n1
InChIInChI=1S/C14H16F3N5O/c1-23-12-4-5-18-13(21-12)19-6-9-2-3-11-20-10(14(15,16)17)8-22(11)7-9/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,19,21)/t9-/m1/s1
InChIKeyDGBQJIAKMUOPKT-SECBINFHSA-N
MW327.31 g/mol
LogP2.38
Rot. Bonds4

About 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine

4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine (PubChem CID 129329079) has the molecular formula C14H16F3N5O and a molecular weight of 327.31 g/mol. Its IUPAC name is 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine
PubChem CID129329079
Molecular FormulaC14H16F3N5O
Molecular Weight327.31 g/mol
Exact Mass327.13
IUPAC Name4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine
SMILESCOc1ccnc(NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)n1
InChIInChI=1S/C14H16F3N5O/c1-23-12-4-5-18-13(21-12)19-6-9-2-3-11-20-10(14(15,16)17)8-22(11)7-9/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,19,21)/t9-/m1/s1
InChIKeyDGBQJIAKMUOPKT-SECBINFHSA-N
XLogP2.38
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.31
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine with MolForge

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Related Compounds

4-[3-(1H-imidazol-2-yl)-1-piperidinyl]-6-methoxypyrimidine
CID 70708404
4-(3-{1-[2-(dimethylamino)ethyl]-1H-imidazol-2-yl}-1-piperidinyl)-6-methoxy-2-pyrimidinamine
CID 72844355
(2-{2-[1-(4,6-dimethoxypyrimidin-2-yl)piperidin-3-yl]-1H-imidazol-1-yl}ethyl)dimethylamine
CID 72874813
4-methoxy-6-{3-[1-(2-methoxyethyl)-1H-imidazol-2-yl]piperidin-1-yl}pyrimidin-2-amine
CID 72910943
4-(4-{1-[3-(dimethylamino)propyl]-1H-imidazol-2-yl}-1-piperidinyl)-6-methoxy-2-pyrimidinamine
CID 72919432
7-(4-methoxypyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 86774428
N-[(2R)-1-imidazol-1-yl-3-methylbutan-2-yl]-6-methoxypyrimidin-4-amine
CID 95144106
N-[[(2S,4S)-4-fluoro-1-(pyrimidin-5-ylmethyl)pyrrolidin-2-yl]methyl]-4-methoxypyrimidin-2-amine
CID 128972810
(Z)-3-imino-2-[4-[6-methoxy-2-[6-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-3,6-dimethylpiperazin-2-yl]prop-1-en-1-amine
CID 139359152
4-methoxy-N-{[6-(trifluoromethyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}pyrimidin-2-amine
CID 126851362
4-methoxy-N-{[7-(trifluoromethyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}pyrimidin-2-amine
CID 126853639
4-Methoxy-2-[3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]pyrimidine
CID 128977623

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine (CID 129329079) is 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine is COc1ccnc(NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)n1.
What is the InChIKey of 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine?
The InChIKey is DGBQJIAKMUOPKT-SECBINFHSA-N. The full InChI is InChI=1S/C14H16F3N5O/c1-23-12-4-5-18-13(21-12)19-6-9-2-3-11-20-10(14(15,16)17)8-22(11)7-9/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,19,21)/t9-/m1/s1.
What are the key properties of 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine?
4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine has a molecular weight of 327.31 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-2-amine is sourced from PubChem (CID 129329079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).