6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine

C19H19F2N5 — CID 153393984

IUPAC6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine
SMILESCc1cn(CC2CN(c3nc(-c4ccc(F)cc4F)ccc3N)C2)cn1
InChIInChI=1S/C19H19F2N5/c1-12-7-25(11-23-12)8-13-9-26(10-13)19-17(22)4-5-18(24-19)15-3-2-14(20)6-16(15)21/h2-7,11,13H,8-10,22H2,1H3
InChIKeyBERQASOUMNZRNV-UHFFFAOYSA-N
MW355.39 g/mol
LogP3.25
Rot. Bonds4

About 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine

6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine (PubChem CID 153393984) has the molecular formula C19H19F2N5 and a molecular weight of 355.39 g/mol. Its IUPAC name is 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine
PubChem CID153393984
Molecular FormulaC19H19F2N5
Molecular Weight355.39 g/mol
Exact Mass355.16
IUPAC Name6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine
SMILESCc1cn(CC2CN(c3nc(-c4ccc(F)cc4F)ccc3N)C2)cn1
InChIInChI=1S/C19H19F2N5/c1-12-7-25(11-23-12)8-13-9-26(10-13)19-17(22)4-5-18(24-19)15-3-2-14(20)6-16(15)21/h2-7,11,13H,8-10,22H2,1H3
InChIKeyBERQASOUMNZRNV-UHFFFAOYSA-N
XLogP3.25
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine;formamide
CID 153393983
4-(4-fluorophenyl)-1-[(1-methylazetidin-3-yl)methyl]imidazole
CID 155674758
4-(2,4-difluorophenyl)-1-ethylimidazole
CID 141121326
2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-[3-[(6-methyl-3-pyridinyl)methyl]azetidin-1-yl]ethanone
CID 158400189
1-[(2,4-difluorophenyl)methyl]-4-methylimidazole
CID 130254978
N-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-3-(pyrazol-1-ylmethyl)azetidine-1-carboxamide
CID 149278130
2-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-1-(2-methyl-5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)ethanone
CID 163822504
4-[1-(cyclopropylmethyl)imidazol-4-yl]-5-(4-fluorophenyl)-2H-triazole
CID 172843445
5-(2,4-difluorophenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
CID 62224859
N-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-3-(pyrazin-2-ylmethyl)azetidine-1-carboxamide
CID 147018729
N-[3-amino-6-(2,4-difluorophenyl)-2-pyridinyl]-2-(oxetan-3-ylmethyl)-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide
CID 155815444
2-(2,4-difluorophenyl)-4-methylpyridine;3-(2-methylpropyl)benzamide
CID 143790958

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine?
The IUPAC name of 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine (CID 153393984) is 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine.
What is the SMILES notation for 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine?
The canonical SMILES for 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine is Cc1cn(CC2CN(c3nc(-c4ccc(F)cc4F)ccc3N)C2)cn1.
What is the InChIKey of 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine?
The InChIKey is BERQASOUMNZRNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N5/c1-12-7-25(11-23-12)8-13-9-26(10-13)19-17(22)4-5-18(24-19)15-3-2-14(20)6-16(15)21/h2-7,11,13H,8-10,22H2,1H3.
What are the key properties of 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine?
6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine has a molecular weight of 355.39 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluorophenyl)-2-[3-[(4-methylimidazol-1-yl)methyl]azetidin-1-yl]pyridin-3-amine is sourced from PubChem (CID 153393984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).