8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine

C22H23FN6O — CID 157085020

IUPAC8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine
SMILESCc1cn2c(NCc3c(F)ccc4c3CCCO4)ncc(-c3cc(C)nn3C)c2n1
InChIInChI=1S/C22H23FN6O/c1-13-9-19(28(3)27-13)17-11-25-22(29-12-14(2)26-21(17)29)24-10-16-15-5-4-8-30-20(15)7-6-18(16)23/h6-7,9,11-12H,4-5,8,10H2,1-3H3,(H,24,25)
InChIKeyZVIMFBOZMBMEBJ-UHFFFAOYSA-N
MW406.47 g/mol
LogP3.82
Rot. Bonds4

About 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine

8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine (PubChem CID 157085020) has the molecular formula C22H23FN6O and a molecular weight of 406.47 g/mol. Its IUPAC name is 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

Compound Name8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine
PubChem CID157085020
Molecular FormulaC22H23FN6O
Molecular Weight406.47 g/mol
Exact Mass406.19
IUPAC Name8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine
SMILESCc1cn2c(NCc3c(F)ccc4c3CCCO4)ncc(-c3cc(C)nn3C)c2n1
InChIInChI=1S/C22H23FN6O/c1-13-9-19(28(3)27-13)17-11-25-22(29-12-14(2)26-21(17)29)24-10-16-15-5-4-8-30-20(15)7-6-18(16)23/h6-7,9,11-12H,4-5,8,10H2,1-3H3,(H,24,25)
InChIKeyZVIMFBOZMBMEBJ-UHFFFAOYSA-N
XLogP3.82
TPSA69.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.47
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-isocyanoimidazo[1,2-c]pyrimidin-5-amine
CID 164935018
2-(diethylaminomethyl)-8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]imidazo[1,2-c]pyrimidin-5-amine
CID 175866305
2-[[bis(2-fluoroethyl)amino]methyl]-8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]imidazo[1,2-c]pyrimidin-5-amine
CID 164935017
N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;bis(8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine);N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(5-methyl-1-propan-2-ylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-amine
CID 162191552
8-[3-[(dimethylamino)methyl]-1-methylpyrazol-5-yl]-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidine-2-carbonitrile
CID 155676982
8-(4-chloro-3-pyridinyl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine
CID 158723029
azetidine;2-(azetidin-1-ylmethyl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methylpyrazol-3-yl)imidazo[1,2-c]pyrimidin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidine-2-carbaldehyde
CID 167567761
8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-3-oxo-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidine-2-carbonitrile
CID 155676962
8-(2-cyclopropyl-4-methylpyrimidin-5-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidine-2-carboxamide;5-(2,3-dihydro-1-benzofuran-4-ylmethylamino)-8-(2,5-dimethylpyrazol-3-yl)imidazo[1,2-c]pyrimidine-2-carboxamide
CID 171794265
5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-[1-methyl-3-(morpholine-4-carbonyl)pyrazol-5-yl]imidazo[1,2-c]pyrimidine-2-carbonitrile
CID 155676935
N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[4-[(3-methoxyazetidin-1-yl)methyl]phenyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine
CID 159024692
5-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyrimidin-8-amine
CID 155235306

Frequently Asked Questions

What is the IUPAC name of 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine?
The IUPAC name of 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine (CID 157085020) is 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine.
What is the SMILES notation for 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine?
The canonical SMILES for 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine is Cc1cn2c(NCc3c(F)ccc4c3CCCO4)ncc(-c3cc(C)nn3C)c2n1.
What is the InChIKey of 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine?
The InChIKey is ZVIMFBOZMBMEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN6O/c1-13-9-19(28(3)27-13)17-11-25-22(29-12-14(2)26-21(17)29)24-10-16-15-5-4-8-30-20(15)7-6-18(16)23/h6-7,9,11-12H,4-5,8,10H2,1-3H3,(H,24,25).
What are the key properties of 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine?
8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 406.47 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,5-dimethylpyrazol-3-yl)-N-[(6-fluoro-3,4-dihydro-2H-chromen-5-yl)methyl]-2-methylimidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 157085020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).