(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine

C19H19BrN4O — CID 129386819

IUPAC(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
SMILESCOc1ccc([C@]2(c3cccc(Br)c3)N=C(N)N3CCCN=C32)cc1
InChIInChI=1S/C19H19BrN4O/c1-25-16-8-6-13(7-9-16)19(14-4-2-5-15(20)12-14)17-22-10-3-11-24(17)18(21)23-19/h2,4-9,12H,3,10-11H2,1H3,(H2,21,23)/t19-/m1/s1
InChIKeyLJWMQUATOGUZBX-LJQANCHMSA-N
MW399.29 g/mol
LogP3.13
Rot. Bonds3

About (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine

(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine (PubChem CID 129386819) has the molecular formula C19H19BrN4O and a molecular weight of 399.29 g/mol. Its IUPAC name is (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine.

Molecular Properties

Compound Name(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
PubChem CID129386819
Molecular FormulaC19H19BrN4O
Molecular Weight399.29 g/mol
Exact Mass398.07
IUPAC Name(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
SMILESCOc1ccc([C@]2(c3cccc(Br)c3)N=C(N)N3CCCN=C32)cc1
InChIInChI=1S/C19H19BrN4O/c1-25-16-8-6-13(7-9-16)19(14-4-2-5-15(20)12-14)17-22-10-3-11-24(17)18(21)23-19/h2,4-9,12H,3,10-11H2,1H3,(H2,21,23)/t19-/m1/s1
InChIKeyLJWMQUATOGUZBX-LJQANCHMSA-N
XLogP3.13
TPSA63.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.29
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-[3-[(4-methoxyphenyl)methyl]phenyl]-8-phenyl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
CID 11618427
8-(3-bromophenyl)-8-thiophen-3-yl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
CID 59030697
8-(3-bromophenyl)-8-(2-methyl-1,3-thiazol-4-yl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
CID 59030681
3-[4-[6-amino-8-(3-bromophenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-8-yl]phenyl]propane-1-sulfonic acid
CID 91222911
[3-[6-amino-8-(3-bromophenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-8-yl]phenyl] difluoro(phosphanyl)methanesulfinate
CID 143594435
[4-[6-amino-8-[3-(3-methoxyphenyl)phenyl]-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-8-yl]phenyl] propane-1-sulfonate
CID 24900118
2-amino-5-(3-bromophenyl)-5-(4-methoxyphenyl)-3-methylimidazol-4-one
CID 25063366
4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine
CID 71680691
8-[3-(2-fluoro-3-methoxyphenyl)phenyl]-8-pyridin-4-yl-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
CID 24989869
4-[6-amino-8-(3-pyrimidin-5-ylphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-8-yl]phenol
CID 71032880
acetic acid;[4-[6-amino-8-(3-pyridin-3-ylphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-8-yl]phenyl] methanesulfonate
CID 24899353
(8R)-8-[3-(5-chloro-3-pyridinyl)phenyl]-8-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
CID 59837919

Frequently Asked Questions

What is the IUPAC name of (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
The IUPAC name of (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine (CID 129386819) is (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine.
What is the SMILES notation for (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
The canonical SMILES for (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine is COc1ccc([C@]2(c3cccc(Br)c3)N=C(N)N3CCCN=C32)cc1.
What is the InChIKey of (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
The InChIKey is LJWMQUATOGUZBX-LJQANCHMSA-N. The full InChI is InChI=1S/C19H19BrN4O/c1-25-16-8-6-13(7-9-16)19(14-4-2-5-15(20)12-14)17-22-10-3-11-24(17)18(21)23-19/h2,4-9,12H,3,10-11H2,1H3,(H2,21,23)/t19-/m1/s1.
What are the key properties of (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine?
(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine has a molecular weight of 399.29 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine is sourced from PubChem (CID 129386819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).